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DeerEyeRain
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train · 715k rows

Output stringlengths 5 127	Input stringlengths 850 1.64k	Instruction stringclasses 1 value
Cc1noc(-c2ccc(CBr)cc2)c1NC(=O)OC(C)c1ccccc1Cl	ir: 2 2 2 5 5 5 4 2 1 2 2 1 1 3 2 1 1 2 2 1 1 2 2 2 8 1 5 2 1 1 3 9 3 1 2 3 2 2 3 1 2 5 23 21 7 8 8 12 4 76 54 2 6 8 7 20 15 4 2 1 3 2 1 0 1 2 2 2 2 8 2 1 2 2 2 4 5 3 2 1 1 1 0 2 1 2 3 3 5 4 9 1 5 16 3 2 2 2 0 1 5 2 0 2 15 3 3 3 2 4 1 2 2 1 1 3 3 19 7 6 2 2 7 4 3 3 3 3 6 4 2 7 17 5 1 4 15 9 67 15 6 7 94 2 3 1 3 2 3 9 39 4 4 2 2 2 2 0 23 0 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 2 2 2 1 1 2 2 4 1 1 2 2 2 5 6 8 16 8 11 100 19 3 2 4 3 2 2 1 1 1 1 2 1 1 1 1 2 2 2 5 3 6 13 29 49 9 11 10 5 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1; 1HNMR: 82 82 s 1H \| 77 77 m 2H \| 75 74 dd 1H J 18 74 \| 74 73 m 3H \| 73 72 m 2H \| 62 61 m 1H \| 44 44 d 2H J 9 \| 23 23 s 2H \| 17 17 d 3H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(C)CC(=O)c2c(Cc3ccccn3)nn(-c3ccc(C#N)c(Br)c3)c2C1	ir: 2 4 7 19 39 16 13 4 1 4 6 8 4 4 4 10 3 2 1 1 3 3 7 10 27 15 10 3 5 5 5 12 1 8 6 13 6 39 72 16 13 5 3 2 2 4 6 5 2 3 3 8 7 43 43 72 47 30 13 4 3 8 7 20 30 13 10 5 28 8 8 7 2 3 1 0 2 4 5 7 9 18 6 1 3 3 4 2 10 56 5 4 6 9 8 2 2 2 1 3 2 2 1 3 3 2 4 2 3 2 1 2 3 2 1 2 5 10 22 19 31 21 17 12 13 6 2 4 2 4 9 10 9 12 26 65 87 93 24 25 22 21 4 3 5 2 3 8 69 21 13 13 12 24 9 100 18 59 6 3 2 3 3 2 1 1 1 1 1 0 1 2 1 0 1 2 1 0 1 1 1 1 56 2 0 0 1 1 1 0 1 2 1 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 2 2 1 0 1 1 0 1 2 2 1 1 2 4 4 3 4 5 9 5 8 4 2 3 14 9 10 24 27 50 47 69 12 13 6 5 8 2 2 1 1 1 1 2 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 86 85 dd 1H J 18 41 \| 80 80 d 1H J 22 \| 78 77 d 1H J 68 \| 76 76 m 2H \| 73 73 dq 1H J 11 73 \| 73 72 ddd 1H J 15 42 73 \| 44 43 d 2H J 9 \| 31 31 s 2H \| 28 28 s 2H \| 12 11 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCCOc1ccc(Sc2ccccc2)cc1	ir: 0 1 1 1 1 1 1 1 4 2 2 3 3 5 1 1 0 0 0 0 0 0 0 0 1 0 0 1 2 4 2 1 2 1 1 0 0 2 1 5 100 18 3 2 1 1 1 0 1 3 2 2 3 26 14 18 5 4 2 1 2 1 1 1 1 7 6 4 20 4 1 1 2 1 2 1 2 0 4 2 1 1 3 0 2 4 2 3 0 0 0 0 1 1 0 2 8 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 2 2 1 0 1 4 3 1 1 1 3 2 1 1 1 0 0 1 0 1 1 3 8 3 0 0 0 1 3 9 5 2 3 3 12 5 5 5 2 2 2 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 1 2 1 0 0 2 0 1 1 1 4 5 21 17 33 8 4 5 4 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 6H \| 72 72 m 1H \| 69 68 m 2H \| 41 41 t 2H J 49 \| 37 36 t 2H J 49 \| 34 34 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=Cc1ccccc1S(=O)(=O)NC(=O)Nc1nc(Cl)nc(Cl)n1	ir: 1 1 1 1 2 3 0 1 6 9 2 2 7 2 1 1 1 1 1 2 11 9 8 5 4 1 1 2 2 2 2 2 3 3 1 3 4 3 15 23 23 5 15 7 3 7 3 2 3 2 2 4 13 46 41 21 12 9 6 3 3 4 1 1 3 4 3 1 1 2 1 4 5 1 1 1 1 1 1 1 3 1 1 1 11 13 10 2 1 1 0 1 0 1 1 2 2 2 1 1 1 2 4 2 1 1 1 13 4 1 0 1 1 1 0 0 0 0 0 0 0 1 1 0 1 1 5 5 1 1 1 0 0 3 2 1 2 10 53 100 10 42 8 6 4 2 66 29 6 3 1 1 1 2 3 8 19 1 0 1 2 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 2 2 6 12 6 4 4 1 3 2 1 1 1 1 1 0 0 0 0 0 1 1 2 3 10 28 8 8 8 15 5 1 1 1 1 1 1 2 3 2 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 82 82 s 1H \| 80 79 dd 1H J 14 86 \| 78 77 s 1H \| 77 76 dd 1H J 16 64 \| 76 75 ddd 1H J 14 75 88 \| 75 75 ddd 1H J 15 64 77 \| 73 72 dd 1H J 109 162 \| 57 56 dd 1H J 24 163 \| 55 55 dd 1H J 24 110	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)N(C)Cc1ccc(CNc2c(Cl)ccc3c2CCNCC3)cc1	ir: 3 3 7 7 2 14 5 8 14 7 24 19 21 13 7 12 28 10 20 3 13 9 8 9 7 5 5 9 18 10 3 6 6 2 5 9 4 3 5 11 14 9 9 16 9 5 17 18 51 39 11 13 53 56 30 69 26 17 14 3 7 6 9 3 20 17 7 9 7 30 9 6 8 5 3 11 8 4 4 5 2 2 2 2 2 4 11 18 25 13 10 23 15 22 26 23 17 5 9 9 13 25 11 11 6 3 0 4 5 7 8 34 17 20 84 63 8 30 30 27 6 6 8 13 26 12 17 7 10 15 2 44 46 75 39 10 11 28 40 38 20 9 22 18 4 4 3 33 18 23 10 6 17 19 2 4 2 3 2 3 2 3 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 1 2 2 1 1 2 2 2 2 3 5 2 3 4 3 3 4 7 8 4 6 4 5 15 24 47 81 25 51 14 14 9 7 3 3 5 7 6 7 3 4 4 4 2 10 15 32 89 78 40 62 25 100 89 16 20 10 8 6 4 2 3 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 72 71 m 5H \| 67 66 dt 1H J 9 87 \| 59 59 m 1H \| 46 45 dt 2H J 8 59 \| 37 36 d 2H J 9 \| 30 29 m 5H \| 29 28 m 4H \| 25 24 p 1H J 46 \| 23 23 d 3H J 15 \| 12 11 d 6H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(CC(c1ccccn1)c1ccccn1)OC	ir: 1 1 1 3 13 4 1 6 5 3 0 1 1 0 0 1 1 1 9 1 1 1 0 4 14 1 1 1 3 12 0 2 1 1 2 2 3 0 47 49 4 6 38 24 2 1 1 2 1 0 1 2 2 18 69 18 2 1 2 16 3 1 6 3 9 10 2 1 2 26 28 12 1 1 3 5 2 1 3 13 5 21 12 3 1 0 1 2 2 2 17 2 1 0 1 1 1 1 2 1 0 5 5 1 0 1 1 1 0 2 2 1 1 1 6 5 2 2 3 3 2 2 2 2 6 2 1 1 0 2 2 3 3 7 32 68 7 39 5 1 1 2 2 1 1 4 2 5 22 7 3 1 1 9 26 0 21 100 4 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 2 3 1 1 2 6 5 1 2 5 9 0 8 41 42 6 3 4 2 1 1 1 1 2 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0; 1HNMR: 86 86 dd 2H J 17 44 \| 77 76 td 2H J 17 73 \| 74 74 ddd 2H J 14 45 71 \| 73 73 m 2H \| 47 46 tq 2H J 13 79 \| 34 33 d 6H J 15 \| 24 24 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)N[C@@H](Cc1ccc(NC(=O)C(=O)OCc2ccccc2)cc1)C(=O)O	ir: 1 5 3 6 3 4 4 5 2 4 3 6 10 10 11 8 4 3 3 4 8 27 51 18 9 12 10 3 8 9 29 44 43 18 7 6 12 4 12 22 21 8 2 5 3 3 2 4 6 2 1 1 1 2 1 3 24 24 6 3 2 0 3 7 2 2 1 7 3 11 2 2 1 0 2 6 1 13 15 25 21 7 2 11 9 7 4 6 19 21 10 3 2 1 1 3 2 5 12 2 2 1 3 7 9 2 1 1 4 11 3 4 3 22 3 0 1 3 2 4 15 20 3 18 11 6 7 3 2 2 1 1 1 6 32 24 6 3 3 8 15 11 21 49 21 86 17 19 19 37 18 42 10 19 8 4 2 1 1 1 0 1 3 6 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 2 1 2 1 2 2 5 2 1 6 19 6 29 100 17 16 3 3 5 3 4 2 2 3 1 1 2 1 2 1 2 2 3 5 11 15 55 37 49 24 9 1 2 2 1 1 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 95 95 s 1H \| 90 90 s 1H \| 79 79 m 2H \| 74 72 m 7H \| 72 72 dt 2H J 9 81 \| 53 52 s 2H \| 43 42 dt 1H J 70 92 \| 37 36 s 2H \| 32 31 ddt 1H J 9 69 141 \| 30 29 ddt 1H J 9 69 141	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccccc1Nc1nc2c(ccc3[nH]c(N)nc32)s1	ir: 12 9 3 3 2 3 2 2 1 6 3 3 2 4 9 6 3 7 12 27 50 27 37 10 11 8 11 16 20 27 13 17 21 30 34 28 8 8 16 15 6 15 33 50 15 10 7 6 4 3 3 3 2 9 10 0 5 6 3 1 3 2 4 1 6 6 1 2 1 1 3 2 3 3 10 6 7 10 3 1 1 3 1 1 2 2 1 1 1 1 1 1 1 8 5 1 2 3 0 1 3 1 1 1 3 4 7 7 9 80 2 15 8 1 1 1 5 4 1 6 3 3 39 14 2 2 0 1 2 1 0 1 3 10 36 4 3 14 14 33 13 6 1 1 4 7 8 5 20 25 28 13 29 68 31 7 19 12 11 2 4 23 12 2 1 1 0 1 1 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 0 1 0 1 0 1 1 1 1 1 1 2 2 1 1 1 3 6 3 16 33 22 12 6 5 6 1 2 3 4 4 2 1 3 2 2 4 3 41 55 2 5 13 6 22 51 35 100 46 20 42 45 10 2 1 3 2 2 1 1 1 0 1 1 0 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 83 82 s 1H \| 79 79 s 1H \| 77 76 d 1H J 92 \| 75 75 dd 1H J 13 77 \| 74 74 d 1H J 92 \| 72 71 td 1H J 13 78 \| 71 70 td 1H J 13 80 \| 70 69 dd 1H J 14 81 \| 69 69 s 2H \| 39 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(Cc1ccccc1Nc1c(Cl)cccc1Cl)ON[C@@H](Cc1c[nH]cn1)C(=O)O	ir: 3 3 3 2 3 5 3 5 2 4 3 2 1 2 2 1 1 1 1 1 1 2 1 2 1 2 1 1 2 4 1 1 1 1 7 8 3 3 8 0 0 6 33 6 2 4 5 14 2 2 1 2 1 1 4 2 2 1 1 1 1 2 1 1 1 1 1 1 1 1 4 0 2 6 1 3 2 1 2 3 1 1 3 2 1 2 3 1 9 6 11 8 13 6 4 1 2 9 5 3 3 3 3 4 10 9 16 20 3 4 3 5 2 5 3 3 5 6 0 2 3 3 4 3 3 2 2 2 2 1 2 2 1 0 0 1 2 2 4 3 4 1 5 8 3 7 4 2 5 1 1 3 5 1 1 1 1 1 1 1 2 1 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 2 3 3 2 2 1 5 2 4 10 4 4 7 100 24 16 5 3 2 2 4 47 5 1 8 1 1 1 0 0 1 1 2 4 1 2 1 5 18 1 1 1 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 78 78 s 1H \| 75 75 dd 1H J 16 59 \| 74 74 d 2H J 81 \| 73 72 ddt 1H J 9 18 76 \| 71 71 m 1H \| 70 69 m 2H \| 69 68 td 1H J 13 74 \| 66 66 d 1H J 73 \| 64 64 dd 1H J 14 79 \| 41 40 q 1H J 68 \| 37 37 d 2H J 8 \| 34 33 ddd 1H J 7 67 147 \| 31 30 ddd 1H J 7 68 145 \| 27 26 dd 1H J 48 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1cc2cc(Cl)ccc2nc1Cl	ir: 2 4 1 1 2 1 8 3 3 3 3 5 5 22 12 9 5 11 17 22 21 25 5 10 14 5 4 5 4 6 4 2 11 5 2 2 1 1 1 1 1 1 1 1 2 4 2 2 2 1 1 1 1 1 7 4 3 29 4 2 1 2 1 1 1 1 1 1 1 3 4 4 20 12 4 14 6 6 26 17 13 10 3 5 4 3 2 2 5 9 1 3 5 4 2 1 1 1 1 1 1 1 2 1 4 2 4 5 1 7 1 1 1 1 1 1 1 1 2 2 1 1 2 1 5 2 3 3 4 2 2 1 0 3 2 2 6 4 2 1 1 2 2 0 1 5 10 81 100 11 7 23 67 11 65 6 5 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 4 8 13 11 7 31 2 1 1 2 1 5 9 11 9 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 85 85 d 1H J 22 \| 80 80 m 2H \| 77 76 dd 1H J 22 81	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(C)c(-c2c(O)cc(C(C)(C)CSc3ccc(C(F)(F)F)cc3)oc2=O)c(C)c1	ir: 0 9 7 10 23 95 71 20 4 4 3 4 5 3 2 37 8 5 4 2 1 3 4 3 1 3 8 3 2 3 5 3 2 8 6 1 1 3 3 3 3 4 3 2 4 5 8 46 30 8 3 3 4 4 20 36 8 1 3 12 24 20 12 3 8 5 14 6 14 29 25 19 43 33 33 22 5 4 2 2 6 6 3 3 7 15 5 5 42 100 9 11 14 41 4 2 4 5 25 16 26 22 3 4 4 3 7 6 8 4 5 3 54 25 27 4 9 4 8 18 5 4 5 5 20 9 5 9 14 11 3 6 11 3 1 3 3 37 2 3 3 1 1 3 13 5 23 15 9 5 4 3 7 0 33 18 1 4 14 76 10 5 3 2 2 1 1 3 1 1 2 3 1 1 2 2 2 1 2 2 2 1 2 3 1 1 2 2 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 3 2 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 4 6 6 3 6 3 2 4 3 4 4 4 5 5 14 34 18 45 96 24 18 25 8 6 4 9 40 5 4 2 1 2 2 1 1 2 2 1 1 3 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2; 1HNMR: 76 75 dq 2H J 14 64 \| 74 74 m 2H \| 70 69 s 2H \| 60 60 s 1H \| 31 31 s 2H \| 24 24 s 7H \| 23 23 s 3H \| 13 13 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(-c2cc3c4n(ccc-3n2)CC(C)=N4)cc1	ir: 1 1 2 1 1 1 3 1 1 2 2 1 1 2 2 3 15 3 3 8 6 1 2 1 1 1 3 2 2 7 4 2 1 2 4 5 5 3 1 1 1 2 1 2 1 1 1 1 2 2 3 1 23 4 12 35 6 1 2 2 2 3 3 4 2 2 2 3 5 6 4 3 4 10 7 2 5 4 9 13 3 1 1 1 1 9 4 2 16 1 2 1 4 1 1 5 14 2 1 1 1 1 1 1 2 3 2 2 1 1 1 1 1 2 2 3 2 3 6 3 2 3 1 2 0 2 6 2 44 18 2 1 2 2 6 3 1 2 7 1 1 34 0 5 57 6 3 1 7 15 8 9 5 11 2 5 4 1 1 1 1 0 1 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 4 1 2 1 2 2 3 6 4 11 10 12 100 38 22 10 33 11 8 4 1 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 85 85 dt 1H J 9 71 \| 78 77 m 2H \| 73 72 s 1H \| 71 71 d 1H J 71 \| 70 69 m 2H \| 43 43 d 2H J 7 \| 38 38 s 3H \| 22 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCC1(CCCNC)Cc2ccccc2N(c2ccccc2)C1=O	ir: 3 1 2 3 3 2 5 4 3 3 1 2 3 2 0 1 2 1 1 1 2 1 0 1 2 2 3 3 2 2 4 5 15 10 16 4 3 4 6 19 24 38 100 40 37 24 23 4 2 2 5 4 3 4 3 2 2 2 2 5 6 3 3 4 3 2 3 5 4 3 3 5 5 5 8 5 2 5 10 7 2 2 2 1 5 5 2 5 2 4 3 9 4 3 4 1 5 3 2 1 7 5 3 3 1 2 7 6 6 15 21 14 17 10 17 10 2 4 10 5 7 3 6 3 3 5 4 2 20 9 7 21 5 10 16 10 5 13 6 5 3 5 6 8 3 8 8 4 37 81 10 11 14 3 3 2 1 1 1 2 8 3 2 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 3 2 2 6 3 4 2 3 2 2 5 5 11 10 18 26 27 47 14 5 3 5 2 3 2 2 2 2 2 3 3 3 3 7 18 65 41 14 14 3 3 1 2 3 2 1 1 2 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 75 74 m 2H \| 75 74 d 1H J 14 \| 74 73 m 2H \| 73 73 dd 1H J 14 73 \| 73 72 td 1H J 18 75 \| 72 71 ddt 1H J 9 18 74 \| 71 70 td 1H J 15 75 \| 30 30 m 1H \| 28 27 dd 1H J 9 145 \| 27 25 m 2H \| 25 24 d 3H J 49 \| 19 18 m 2H \| 18 17 qt 1H J 37 49 \| 17 16 m 3H \| 16 14 m 2H \| 14 13 dqt 1H J 68 79 134 \| 10 9 t 3H J 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H](O)CCCCn1c(=O)c2c(nnn2C)n(C)c1=O	ir: 3 5 14 16 6 9 9 7 14 17 17 5 6 11 13 10 13 20 12 10 6 5 4 7 5 6 11 2 2 2 2 3 2 1 1 1 2 2 2 2 2 2 2 4 3 2 4 3 3 2 12 27 48 62 10 12 15 14 19 10 8 8 2 2 3 1 3 3 7 5 5 5 9 10 3 1 2 4 2 1 4 6 3 3 3 8 13 6 4 7 8 15 12 19 22 37 12 19 8 9 9 5 2 3 4 6 6 3 3 2 4 18 8 4 4 7 6 7 20 8 5 7 2 3 6 15 13 5 4 6 5 6 2 4 5 6 8 5 3 3 2 4 2 1 2 2 1 1 1 1 1 1 1 2 2 1 100 0 3 6 46 71 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 2 2 2 2 3 5 4 6 2 3 4 4 4 5 11 4 9 5 4 4 7 4 36 61 16 20 5 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 42 41 s 2H \| 39 38 s 2H \| 38 37 m 3H \| 25 24 d 1H J 53 \| 17 13 m 7H \| 11 11 d 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(OC)c(-n2c(C)cc(OCc3ccc(F)cc3F)cc2=O)c1	ir: 2 3 9 3 8 9 5 4 3 2 2 2 3 3 2 3 2 2 4 4 3 4 7 10 7 2 1 1 3 3 8 5 1 1 1 4 4 1 1 2 3 4 8 11 2 2 1 2 1 1 2 2 1 5 18 15 10 0 3 6 2 1 4 17 2 7 27 96 43 17 8 18 3 4 14 14 2 3 1 3 1 1 1 1 1 2 3 2 1 1 2 7 6 3 7 7 5 7 3 3 2 2 1 3 3 1 1 1 3 2 3 2 2 1 11 16 11 6 4 2 2 3 4 2 4 5 4 3 3 6 2 3 3 11 2 3 2 2 3 3 4 2 67 13 4 27 2 3 11 40 7 14 22 3 2 3 4 33 4 0 4 8 15 6 2 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 2 3 1 0 1 2 1 0 2 3 2 1 4 15 24 5 14 100 21 58 23 12 2 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 81 81 d 1H J 22 \| 77 76 dd 1H J 22 90 \| 74 73 dtt 1H J 9 47 79 \| 70 70 d 1H J 90 \| 69 68 m 2H \| 64 63 p 1H J 12 \| 55 55 d 1H J 7 \| 53 52 dd 2H J 8 36 \| 39 39 s 3H \| 39 38 s 3H \| 24 24 d 3H J 14	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(CCCC1(c2ccc(F)cc2)OCCO1)CC(=O)N1CCC(Oc2ccccc2)CC1	ir: 2 3 1 4 2 2 2 5 2 4 2 1 3 11 2 2 8 2 7 7 12 2 1 5 1 4 4 4 7 20 16 5 3 4 27 3 2 2 3 3 66 17 13 5 2 7 3 1 2 2 4 5 5 7 33 21 22 4 2 3 3 2 5 9 2 4 4 56 6 11 3 7 3 4 2 10 2 4 4 19 18 13 5 3 3 5 1 2 2 5 5 20 4 2 2 1 3 4 2 2 4 17 5 5 4 5 3 4 9 17 12 9 13 10 6 5 3 2 7 9 6 5 4 4 5 8 34 11 5 1 3 14 2 2 5 19 6 7 4 4 2 2 3 17 13 5 5 12 19 37 7 22 13 9 2 1 1 1 1 13 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 9 5 3 4 0 2 3 7 7 19 8 31 63 100 12 10 2 3 1 2 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 74 73 m 2H \| 72 72 m 2H \| 71 71 m 2H \| 70 70 tt 1H J 14 74 \| 69 69 m 2H \| 45 44 p 1H J 46 \| 40 40 m 2H \| 38 38 m 2H \| 37 37 ddd 2H J 60 88 123 \| 34 33 ddd 2H J 60 87 123 \| 33 33 s 2H \| 28 27 t 2H J 60 \| 24 24 s 2H \| 23 22 m 4H \| 20 19 dddd 2H J 46 60 88 132 \| 18 17 tt 2H J 60 81	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCC(O)C/C=C1\C(=O)NC(=O)N1CCCCCCC(=O)O	ir: 1 1 0 0 1 1 1 2 2 1 3 1 1 1 0 1 1 1 1 1 1 2 7 3 2 1 1 1 1 0 1 1 2 1 1 1 3 2 1 1 1 0 1 4 4 2 1 2 7 21 20 4 1 2 0 2 1 0 1 1 1 0 0 1 1 0 1 1 1 2 0 1 1 1 1 1 1 1 2 3 2 1 2 1 1 3 2 3 12 5 2 1 1 1 1 1 0 0 0 1 0 1 1 2 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 3 5 2 6 3 2 2 1 1 1 1 2 1 0 0 0 0 0 1 1 1 1 1 1 1 3 9 1 0 1 0 0 1 1 1 0 0 0 0 1 1 2 0 100 12 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 1 2 1 1 1 1 1 1 2 2 5 1 2 1 1 1 1 1 1 1 3 14 58 8 2 1 1 1 0 0 0 1 1 0 1 1 6 7 8 1 0 1 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 100 99 s 1H \| 59 58 td 1H J 17 78 \| 42 42 d 1H J 60 \| 39 37 m 3H \| 26 25 dt 1H J 77 156 \| 23 22 m 3H \| 17 15 m 3H \| 15 12 m 14H \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1cc(-c2csc(-c3ccnc(NCc4cccnc4)c3)n2)c(=O)[nH]c1C	ir: 12 10 12 11 5 9 8 18 14 14 43 22 2 8 15 5 3 8 9 6 2 8 9 5 4 9 8 11 8 10 12 7 14 21 18 13 8 9 6 5 8 10 7 3 5 20 19 32 38 39 19 4 8 12 9 0 9 11 6 0 6 9 5 7 7 10 22 9 14 25 7 4 14 23 13 17 9 9 6 2 10 10 3 7 8 7 4 5 8 6 3 4 10 8 8 9 8 10 4 4 9 7 1 13 12 7 4 45 10 7 1 6 17 8 2 6 11 10 6 11 11 6 4 9 16 6 3 10 11 10 4 14 7 5 8 6 7 18 10 14 10 36 16 14 10 5 4 9 58 2 4 12 81 14 8 17 100 11 25 10 12 63 12 8 5 3 7 25 5 2 4 7 4 1 4 7 4 1 5 7 4 1 5 7 3 2 5 7 3 2 5 6 3 2 6 6 3 2 6 6 3 3 6 6 2 3 6 5 2 3 6 5 2 3 6 5 2 4 7 5 2 4 7 4 1 4 7 4 1 4 7 4 2 5 7 4 2 5 7 4 2 5 6 3 2 5 6 3 2 5 6 3 3 5 6 3 3 6 6 3 3 6 5 3 3 6 5 3 4 8 7 3 4 7 6 4 4 7 5 2 5 9 6 7 11 15 7 15 23 14 6 3 6 9 5 3 5 7 4 2 5 7 4 3 7 8 4 7 7 13 10 39 50 14 8 4 8 6 3 5 7 5 3 3 6 5 2 4 6 5 2 4 6 5 2 4 6 4 2 4 7 4 2 4 7 4 2 4 6 4 2 5 6 4 2 5 6 4 2 5 6 3 3 5 6 3 3 5 5 3 3 5 5 3 3 5 5 3 3 6 5 3 3 6 5 3 4 6 5 2 4 6 4 2 4 6 4 2 4 6; 1HNMR: 87 86 dq 1H J 10 22 \| 85 84 m 2H \| 84 84 d 1H J 47 \| 79 79 s 1H \| 78 77 m 2H \| 73 72 dd 1H J 43 78 \| 72 72 d 1H J 22 \| 66 65 t 1H J 61 \| 47 47 dt 2H J 9 61 \| 43 43 q 2H J 71 \| 26 26 s 3H \| 13 12 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2cc(-c3cc4cc(Cl)ccc4o3)ccc2c1	ir: 1 1 1 1 2 3 1 3 8 3 7 19 2 3 4 4 3 2 4 1 0 3 4 1 0 1 2 1 1 1 2 2 5 1 2 1 1 3 1 2 1 7 12 3 1 3 3 3 3 1 1 3 3 8 35 5 3 3 3 7 14 6 12 9 10 2 12 12 32 8 3 1 1 2 2 1 1 3 3 4 2 1 2 1 0 2 2 2 10 14 10 1 5 4 2 1 1 1 5 13 6 12 0 17 18 2 1 1 2 2 1 1 5 2 2 1 2 5 3 1 3 2 2 3 4 6 4 4 5 2 0 1 1 0 1 5 3 3 2 1 1 5 14 4 13 10 2 1 1 0 1 1 2 16 9 10 9 6 29 2 1 1 1 0 1 1 0 0 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 2 2 1 3 7 7 85 96 100 25 12 6 1 3 2 1 0 1 2 1 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 83 83 t 1H J 22 \| 79 79 dd 1H J 22 95 \| 79 78 ddd 2H J 21 91 167 \| 77 76 t 1H J 21 \| 75 75 d 1H J 86 \| 74 74 dd 1H J 22 84 \| 73 73 t 1H J 21 \| 71 71 dd 1H J 24 88 \| 71 70 d 1H J 23 \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc2ccc3c(=O)c(-c4ccc(C5(N)CCC5)cc4)c(-c4ccccc4)oc3c2n1C	ir: 0 0 2 2 0 1 1 1 0 2 10 1 1 2 1 1 1 2 2 1 1 4 1 1 0 1 1 2 2 2 2 1 0 11 1 1 1 2 6 8 2 19 4 1 1 2 2 27 4 3 2 0 17 1 2 9 33 3 3 5 2 2 1 1 2 2 2 2 6 61 5 7 6 3 1 1 1 1 1 2 1 2 1 5 2 1 2 1 1 1 1 1 1 1 1 1 4 1 2 1 1 1 1 1 7 2 1 3 1 2 10 1 2 1 1 2 3 11 4 2 1 2 1 2 3 8 2 3 9 6 10 10 29 38 4 3 4 3 2 6 2 1 1 0 67 3 1 2 2 6 7 2 5 1 1 2 1 14 1 1 1 2 12 19 0 1 1 0 0 1 0 1 0 0 1 1 1 0 1 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 2 2 1 1 2 3 2 9 5 18 36 22 13 3 3 5 2 1 1 1 1 1 0 2 40 19 2 2 3 3 6 3 100 3 1 2 1 1 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 81 81 d 1H J 79 \| 79 79 m 2H \| 77 76 m 3H \| 74 74 m 3H \| 74 73 m 2H \| 38 37 s 3H \| 28 27 s 2H \| 25 25 s 3H \| 23 22 dt 2H J 73 138 \| 20 19 dt 2H J 73 137 \| 18 17 pd 2H J 16 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCc1cc(CBr)cc(CCC)c1OC(C(=O)OC)c1cccc(Cl)c1	ir: 13 8 14 3 5 8 5 2 2 2 2 2 1 3 3 2 3 4 2 3 2 2 2 0 1 1 1 2 3 2 3 12 18 12 5 3 4 3 2 2 3 1 3 4 3 7 14 28 12 4 1 0 1 1 1 1 1 6 2 1 1 1 2 5 5 5 7 8 22 4 2 1 1 1 3 15 11 4 4 2 1 1 1 1 1 1 5 13 10 2 1 1 1 4 6 2 3 1 3 2 3 5 10 8 4 3 2 5 4 4 5 5 9 8 7 5 8 9 15 14 4 4 3 2 3 2 2 16 9 2 1 1 1 1 2 2 1 4 2 21 7 3 2 1 13 14 10 2 2 0 0 2 1 0 24 4 1 1 1 1 1 14 2 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 2 1 1 3 2 1 2 3 2 1 2 4 8 8 17 18 25 100 41 4 6 4 3 1 2 1 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 75 75 dt 1H J 14 26 \| 75 74 m 2H \| 73 73 m 1H \| 70 69 t 2H J 9 \| 58 58 s 1H \| 45 44 t 2H J 9 \| 38 38 s 2H \| 27 26 td 4H J 8 64 \| 17 16 qt 4H J 64 76 \| 10 9 t 6H J 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C1CCN(C(=O)OC)C(Cc2ccc(F)cc2)C1	ir: 6 8 14 6 5 6 10 9 9 6 5 7 9 9 37 5 17 12 6 2 4 5 4 2 2 1 1 2 1 1 1 2 4 2 1 1 4 1 2 9 2 1 1 1 2 1 1 2 2 1 3 3 2 1 13 100 16 15 4 4 4 2 1 1 2 2 2 1 5 9 3 3 5 1 1 1 1 1 1 1 1 1 1 1 1 1 3 6 1 1 1 3 1 1 2 3 6 21 9 4 3 8 6 7 4 7 2 7 5 8 6 10 16 7 16 13 6 10 3 6 8 9 11 3 8 8 5 5 3 8 6 4 2 4 2 6 7 4 4 2 2 2 4 8 8 5 11 45 22 4 8 36 11 2 0 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 1 1 1 1 2 2 4 4 2 3 2 4 6 9 6 29 9 14 53 14 6 3 3 5 1 2 1 1 1 1 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 72 72 ddt 2H J 9 35 78 \| 71 70 m 2H \| 41 40 p 1H J 74 \| 38 37 ddd 1H J 61 89 124 \| 37 37 s 2H \| 37 36 s 2H \| 35 34 ddd 1H J 62 90 125 \| 31 30 ddt 1H J 9 75 130 \| 30 29 m 1H \| 29 28 ddt 1H J 9 75 130 \| 26 25 dt 1H J 72 130 \| 22 20 m 2H \| 19 18 ddt 1H J 61 90 126	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)OCCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(CCN)c1=O	ir: 2 1 2 1 1 1 1 2 1 2 4 2 5 3 2 2 4 3 1 4 1 1 2 1 0 1 1 0 0 1 2 1 2 6 6 19 5 3 3 0 3 6 2 3 2 7 13 16 1 1 2 1 4 11 16 3 21 59 8 7 6 1 1 2 2 1 2 3 7 6 2 4 14 4 9 25 7 4 1 1 3 5 4 7 2 2 1 1 1 1 1 1 1 1 3 2 3 2 10 4 5 25 32 4 0 1 2 2 0 3 5 22 8 1 1 2 1 1 1 2 2 2 3 4 4 4 4 3 6 8 6 5 20 14 12 21 8 3 2 1 1 1 14 6 2 2 5 51 12 9 1 1 7 39 4 6 1 1 0 3 10 2 1 3 11 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 1 1 1 0 1 2 2 1 2 1 1 1 1 2 3 3 9 5 17 33 34 25 10 4 2 1 1 1 1 1 2 0 2 6 5 7 3 2 2 2 8 100 38 4 27 11 5 2 2 1 2 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 82 81 dt 1H J 9 16 \| 77 77 dt 1H J 9 16 \| 76 76 t 1H J 59 \| 73 72 ddt 2H J 9 35 80 \| 71 70 m 2H \| 43 43 t 2H J 55 \| 40 40 p 2H J 9 \| 37 36 hept 1H J 56 \| 36 36 t 2H J 39 \| 34 33 dt 2H J 39 60 \| 31 30 tt 2H J 55 68 \| 27 26 t 2H J 67 \| 12 11 d 6H J 55	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)CC(C)(C)N(C(=O)C1CC1)c1cc2[nH]ccc2cn1	ir: 7 10 20 32 5 9 17 12 17 17 19 7 2 11 16 9 10 19 21 7 3 90 100 11 6 12 13 10 12 15 12 4 5 13 12 7 31 20 14 14 44 46 19 17 9 18 10 4 23 24 12 3 10 17 9 1 13 19 20 6 10 19 12 4 15 24 18 30 24 36 11 3 12 14 7 4 11 14 5 6 12 13 5 5 13 13 8 14 16 18 12 15 25 17 5 10 17 14 4 8 15 12 4 34 23 11 2 8 15 9 1 9 18 12 1 9 17 8 8 21 29 17 9 12 20 16 7 14 18 10 6 14 21 15 0 51 43 16 16 25 23 25 12 23 15 13 17 48 65 58 20 19 17 4 8 19 47 6 8 13 10 6 9 52 20 0 8 16 9 0 8 16 8 1 9 15 7 1 9 14 7 2 9 14 6 3 10 13 6 3 10 13 5 4 11 12 5 4 11 12 5 5 12 11 4 5 12 10 4 6 13 10 3 6 13 10 3 7 13 9 2 7 14 9 2 8 14 8 2 8 14 8 2 9 14 7 3 9 13 7 3 10 13 7 4 10 12 6 4 10 12 6 5 11 12 5 5 11 11 5 6 12 11 5 6 12 10 4 7 13 10 6 11 13 10 4 8 14 10 4 10 19 18 43 22 31 28 29 21 41 52 49 30 16 9 6 11 13 7 4 10 13 7 5 10 13 7 5 11 11 6 9 30 51 80 8 12 11 5 6 13 10 5 6 12 10 4 7 12 9 4 7 13 9 3 7 13 9 3 8 13 8 3 8 13 8 3 8 13 7 4 9 12 7 4 9 12 7 4 10 12 6 5 10 11 6 5 10 11 6 5 11 10 5 6 11 10 5 6 11 10 5 7 11 9 4 7 12 9 4 7 12 9 4 8 12 8 3 8 13; 1HNMR: 97 96 d 1H J 68 \| 88 88 d 1H J 18 \| 73 73 dd 1H J 40 65 \| 70 70 s 1H \| 67 67 dd 1H J 19 41 \| 25 25 p 1H J 56 \| 18 17 s 2H \| 15 15 s 5H \| 12 12 m 2H \| 10 9 m 2H \| 10 9 s 10H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNc1ccc(C(=O)NCc2ccc(Oc3cccc(C)c3)s2)cn1	ir: 2 3 2 3 6 11 12 6 9 6 6 8 18 27 14 20 16 24 3 11 12 17 13 16 5 6 7 3 5 9 6 6 4 4 4 6 5 18 8 37 24 13 12 5 4 3 11 24 14 5 6 14 39 22 31 17 9 11 4 18 15 4 3 3 5 5 3 11 10 6 9 15 12 4 2 2 3 5 4 7 3 2 2 2 3 3 2 3 8 10 4 13 3 3 10 16 4 3 3 2 3 2 1 1 2 2 1 2 3 5 3 3 8 7 2 3 2 6 5 5 5 8 5 16 27 23 8 14 9 6 6 3 3 1 1 2 3 1 2 4 8 16 14 92 79 33 19 16 14 8 14 31 22 19 43 39 15 2 4 4 9 27 100 18 5 4 2 0 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 2 2 1 2 2 1 2 3 5 5 6 11 31 43 54 10 15 6 3 3 3 3 2 3 3 2 5 4 4 4 2 3 3 6 15 13 49 28 52 28 26 33 22 4 6 5 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 87 d 1H J 19 \| 82 82 t 1H J 47 \| 80 80 dd 1H J 18 81 \| 72 72 m 2H \| 70 70 d 1H J 82 \| 69 69 m 1H \| 68 67 ddd 1H J 12 21 75 \| 67 66 dd 1H J 19 26 \| 66 65 d 1H J 71 \| 57 56 q 1H J 48 \| 46 46 dd 2H J 8 47 \| 29 29 d 3H J 48 \| 23 23 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC(=O)c1cccc2nc(-c3cccc(CN4CCNCC4)c3)oc12	ir: 2 3 2 2 1 3 4 4 8 7 1 5 5 26 8 5 4 34 39 13 5 9 13 2 5 5 3 8 3 4 7 5 23 3 31 23 4 4 3 9 74 36 6 1 5 8 21 8 12 5 5 1 7 9 37 16 14 15 13 7 4 3 5 2 4 1 14 15 9 9 3 2 4 3 6 1 2 12 2 5 18 6 10 13 6 8 5 3 12 11 3 3 11 8 2 2 3 7 4 4 7 2 3 2 4 3 4 7 42 40 26 18 6 4 11 12 23 8 4 3 3 8 9 5 3 4 11 4 8 12 9 5 4 16 28 6 8 11 3 1 10 34 7 6 36 1 1 2 1 1 3 31 4 8 5 2 8 33 8 49 4 4 1 1 1 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 2 1 2 2 1 1 1 2 1 0 10 10 16 42 58 11 4 1 2 2 1 1 1 1 1 1 4 3 3 3 22 76 21 74 29 11 6 5 3 1 1 2 5 30 100 3 2 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 80 79 m 2H \| 78 77 tt 1H J 9 21 \| 78 77 dd 1H J 15 91 \| 75 74 m 2H \| 74 73 ddq 1H J 10 21 81 \| 73 73 s 2H \| 36 36 d 2H J 9 \| 28 27 dddd 8H J 21 39 46 79 \| 27 26 p 1H J 31	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)Nc1cc(F)c(F)c2c1CCCC2	ir: 11 6 0 6 11 5 1 6 10 5 1 8 11 5 7 9 10 5 10 17 11 5 4 15 28 10 5 9 11 4 5 13 32 54 20 15 17 22 7 9 8 2 4 10 7 2 5 11 6 2 6 10 8 7 6 12 6 0 6 11 5 0 7 12 6 2 20 37 14 40 50 12 8 5 8 9 6 6 8 9 5 3 8 8 3 3 8 8 3 3 8 7 3 4 9 10 4 5 9 11 3 5 9 7 2 7 12 15 13 8 13 8 2 7 14 8 4 7 14 8 6 12 14 8 3 9 11 7 3 8 9 5 2 7 8 4 5 15 11 7 5 7 9 19 42 100 48 5 13 10 8 2 4 10 26 82 9 11 8 5 9 37 7 1 5 10 6 1 6 10 6 1 6 10 5 1 6 10 5 1 6 9 5 2 6 9 4 2 7 8 4 3 7 8 4 3 7 8 3 3 7 7 3 4 8 7 3 4 8 7 2 4 8 6 2 4 9 6 2 5 9 6 2 5 9 6 1 5 9 5 2 6 9 5 2 6 9 5 2 6 8 4 2 7 8 4 3 7 8 4 3 7 8 4 3 7 7 3 4 7 7 3 4 8 7 3 4 8 7 3 7 9 7 4 7 13 9 4 6 9 6 4 6 17 20 7 9 30 27 9 9 11 6 2 7 10 5 4 8 9 6 3 7 8 6 4 12 15 13 26 22 40 40 24 14 13 4 4 8 8 4 4 8 7 3 5 8 7 3 5 8 6 2 5 8 6 3 5 9 6 2 5 9 5 2 6 9 5 2 6 8 5 3 6 8 5 3 6 8 4 3 6 7 4 3 7 7 4 4 7 7 4 4 7 7 4 4 7 6 3 4 7 6 3 5 8 6 3 5 8 6 3 5 8 6 3 5 8 5 2; 1HNMR: 91 91 s 1H \| 73 72 dd 1H J 44 121 \| 29 28 m 3H \| 29 28 m 1H \| 21 20 s 2H \| 19 17 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C=NCC1CCCC1N=C=O	ir: 12 14 7 11 13 9 18 20 14 13 6 12 11 10 5 13 14 19 17 7 7 13 13 9 12 13 8 18 12 11 7 10 5 10 6 8 8 4 8 5 9 5 9 9 7 7 4 6 6 5 5 9 5 4 4 11 5 2 6 8 4 1 8 11 7 2 5 5 3 1 4 6 3 1 5 6 2 2 4 5 2 1 4 4 2 1 4 4 1 3 6 7 5 4 10 6 2 2 5 3 1 2 5 4 1 6 6 6 4 5 7 5 2 4 7 3 2 4 6 4 1 5 6 4 2 6 6 3 2 4 5 2 1 4 4 2 1 3 4 1 1 4 4 1 1 4 3 1 1 4 3 1 2 4 3 1 2 4 3 1 2 4 3 0 2 4 3 0 2 4 2 0 2 4 2 0 3 4 2 1 3 4 2 1 3 4 4 2 5 44 100 1 5 5 1 1 4 4 1 1 4 4 1 1 4 3 1 1 4 3 1 2 4 3 0 2 4 3 0 2 4 3 0 2 4 2 0 2 5 2 0 2 4 2 0 3 4 2 0 3 4 2 1 3 4 2 1 3 4 2 1 3 4 1 1 3 3 1 1 3 3 1 1 4 3 1 2 4 3 1 2 4 4 1 3 6 5 2 4 7 5 2 5 7 5 1 3 4 2 1 2 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 2 1 2 4 2 1 2 4 2 1 2 4 2 1 2 4 2 1 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 1 3 3 1 1 3 3 1 2 3 3 1 2 3 3 1 2 4 3 1 2 4 3 1 2 4 2 1 2 4 2 1; 1HNMR: 34 33 dd 1H J 39 110 \| 33 33 dt 1H J 41 57 \| 31 31 dd 1H J 40 110 \| 21 20 dddd 1H J 43 57 72 114 \| 20 19 dp 1H J 39 57 \| 19 17 m 3H \| 17 16 ddtd 1H J 37 55 71 125 \| 16 15 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
c1ccc(C2=NCCN2C(c2ccccc2)c2ccccc2)cc1	ir: 18 7 2 3 5 4 1 5 12 13 23 46 18 8 4 5 5 4 1 3 3 2 2 12 3 12 5 5 7 6 32 28 49 33 6 6 7 10 42 23 66 62 18 24 11 3 4 5 4 1 2 5 4 2 2 3 4 7 3 4 2 1 3 5 15 0 5 11 39 27 7 9 4 2 3 5 11 13 18 10 2 1 3 4 4 6 8 12 24 26 22 20 8 5 4 3 5 11 1 10 3 4 3 2 1 2 3 2 1 2 4 4 2 4 8 6 2 5 10 7 7 9 6 7 9 19 17 13 25 76 42 12 6 14 59 85 13 4 7 5 17 42 62 47 57 32 43 17 6 2 2 9 44 4 3 3 2 3 2 3 10 2 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 2 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 3 5 3 3 5 4 5 5 7 12 32 35 35 72 100 25 21 8 4 7 6 8 6 5 6 4 2 1 4 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1; 1HNMR: 79 78 m 2H \| 75 75 m 0H \| 75 75 s 1H \| 75 74 m 1H \| 75 75 s 1H \| 73 73 d 8H J 48 \| 73 72 m 2H \| 55 55 s 1H \| 40 39 m 2H \| 38 38 dd 2H J 38 51	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCc1ccc(C(NC(C)=O)C(=O)OC)cc1O	ir: 4 8 4 7 2 2 1 1 4 2 2 2 2 2 3 1 1 3 5 6 3 3 2 2 6 3 2 9 3 3 7 10 17 9 3 4 5 5 4 5 1 1 2 2 4 3 3 3 4 1 1 2 1 3 6 3 2 3 1 3 1 1 2 3 4 10 10 5 10 10 4 7 5 5 3 4 2 4 4 3 4 12 24 23 19 24 13 3 2 1 3 2 1 4 5 3 3 2 2 3 2 1 2 2 1 1 1 1 1 1 1 2 1 2 1 4 2 6 9 8 15 4 12 10 3 2 3 3 2 4 2 1 1 1 3 5 3 5 4 3 3 4 6 29 55 30 8 7 3 4 2 2 1 3 3 1 0 1 1 0 1 1 6 0 0 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 2 1 1 1 1 1 1 2 1 1 0 1 2 2 1 2 4 4 3 2 4 11 7 8 27 7 3 5 4 4 1 10 100 18 7 3 1 1 1 1 1 2 1 2 5 5 8 6 8 16 8 2 1 1 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 72 71 m 2H \| 71 70 m 1H \| 69 68 dd 1H J 7 20 \| 64 64 s 1H \| 59 58 ddt 1H J 79 101 168 \| 55 54 dd 1H J 8 86 \| 51 50 m 1H \| 50 49 m 1H \| 37 36 s 3H \| 33 33 m 2H \| 20 20 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(-c2ccc(C(C)N(C)C)cc2)ccc1C=O	ir: 7 6 4 9 9 9 0 6 4 3 1 5 6 6 5 7 4 11 4 3 5 2 1 3 3 5 8 4 4 2 2 6 3 2 2 3 2 1 2 3 4 2 2 3 11 10 3 5 3 4 5 11 20 51 48 28 26 3 2 4 6 14 5 6 5 11 13 6 8 9 4 26 4 6 6 8 4 5 5 5 2 3 4 3 2 6 12 32 8 5 12 7 18 13 21 24 37 14 7 8 5 3 5 4 1 2 5 3 7 29 9 6 0 4 8 4 11 20 14 4 5 5 8 9 9 6 7 3 3 9 9 17 17 5 7 3 5 9 30 2 1 3 4 1 1 12 54 44 4 10 6 3 8 17 7 4 20 12 8 4 17 5 3 1 4 4 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 0 2 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 2 4 4 2 1 2 3 3 2 3 3 6 2 6 14 15 11 34 100 43 11 12 8 5 3 3 4 3 1 3 3 2 1 2 3 1 1 2 2 2 1 2 3 1 1 3 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1; 1HNMR: 78 78 d 1H J 82 \| 77 76 dd 1H J 22 82 \| 76 76 m 2H \| 76 75 m 1H \| 73 72 m 2H \| 34 33 m 1H \| 24 24 s 3H \| 23 22 d 7H J 16 \| 14 14 d 3H J 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(-c2ccnc(C)c2C#Cc2ccc(N)nc2)cc1	ir: 6 13 3 18 7 12 7 7 10 8 14 8 7 8 17 11 12 14 11 12 22 12 4 3 5 8 4 12 5 3 1 5 10 11 12 13 32 27 7 7 7 6 5 5 7 27 7 9 4 4 4 5 26 42 24 18 26 10 7 9 3 1 2 5 2 1 4 3 15 13 10 6 9 9 5 4 3 4 8 3 2 3 1 3 4 2 4 4 4 5 4 3 11 3 5 4 19 3 2 2 1 1 1 1 2 1 2 3 2 2 1 1 2 2 3 25 11 12 5 5 10 5 5 9 24 10 5 4 3 2 3 3 4 5 2 7 25 25 17 11 5 7 8 25 11 12 25 79 70 27 32 50 21 18 14 3 3 11 8 7 45 10 2 2 2 3 2 0 1 2 1 0 1 1 1 0 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 1 1 1 1 1 2 2 2 2 3 3 2 2 12 17 12 100 25 12 6 7 5 1 2 4 3 2 2 3 1 1 3 4 4 5 41 5 3 2 2 2 2 1 2 4 12 79 66 40 5 2 2 1 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 85 85 d 1H J 38 \| 84 84 d 1H J 19 \| 80 80 m 2H \| 77 76 m 2H \| 76 76 dd 1H J 20 75 \| 75 75 d 1H J 38 \| 66 66 d 1H J 75 \| 55 55 s 2H \| 39 39 s 3H \| 26 25 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNC(=O)CSP(=S)(OC)OC	ir: 5 4 3 3 2 1 1 1 2 2 4 6 3 2 1 3 9 4 2 3 3 3 3 9 6 8 16 11 17 27 40 24 16 13 4 5 4 2 1 2 6 2 6 13 14 10 7 22 11 15 20 14 6 2 2 3 2 1 1 2 1 1 2 3 4 5 4 4 19 61 55 15 2 1 4 4 2 6 8 4 1 1 2 2 1 1 2 3 2 1 2 2 1 1 2 2 2 2 3 3 0 1 2 2 1 1 3 2 0 1 4 3 2 4 3 4 1 6 12 7 5 5 6 7 28 7 5 5 3 2 2 1 1 2 2 1 1 2 2 2 2 5 12 34 60 100 47 11 3 4 3 3 2 4 2 1 1 3 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 4 2 3 2 1 4 3 3 2 4 3 2 2 4 12 19 17 3 4 3 1 2 3 2 1 2 2 2 1 2 3 3 1 3 3 4 3 4 5 6 16 25 24 26 22 16 7 3 3 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 63 62 q 1H J 47 \| 38 38 d 5H J 110 \| 36 36 s 2H \| 28 28 d 3H J 47	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc2cc(CN3NCc4c3ccnc4NCc3ccc4c(N)nccc4c3)ccc2n1C	ir: 5 4 6 2 3 3 3 4 4 3 2 5 5 2 1 4 5 7 1 4 11 7 4 1 3 4 3 2 9 11 6 4 7 6 3 1 12 2 3 6 3 2 3 2 9 10 4 5 5 7 7 8 8 4 4 3 1 3 2 2 1 2 2 2 7 6 4 15 4 4 3 3 9 4 6 10 2 4 1 4 1 1 2 2 1 1 1 1 3 1 4 2 4 2 2 2 3 6 0 3 1 3 1 1 1 1 2 2 1 2 1 1 5 3 4 43 3 6 1 2 5 2 1 4 4 3 1 10 2 2 1 1 1 1 1 4 9 27 12 14 4 4 3 3 4 4 16 9 2 2 26 5 31 19 9 1 8 5 3 19 7 1 1 2 1 0 1 16 0 1 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 2 1 0 1 0 1 1 1 1 1 1 1 1 1 1 3 6 18 12 30 16 9 2 2 2 2 1 1 1 0 1 1 0 2 2 2 3 14 100 6 4 7 14 26 6 6 1 7 4 78 5 0 1 2 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 79 79 m 2H \| 79 78 d 1H J 45 \| 77 77 td 1H J 10 24 \| 74 73 m 2H \| 73 72 ddt 1H J 8 19 90 \| 73 72 m 5H \| 68 67 d 1H J 51 \| 51 50 t 1H J 48 \| 50 50 d 1H J 23 \| 47 47 dt 2H J 8 55 \| 46 45 t 2H J 9 \| 43 43 d 2H J 49 \| 35 35 s 2H \| 23 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1cn([C@H](C)CO)c2ccc(I)cc2c1=O	ir: 14 4 10 5 3 3 3 1 1 3 4 1 2 10 5 2 4 2 21 12 3 13 3 1 0 2 3 2 0 2 2 1 1 2 2 7 2 2 3 2 2 2 2 1 2 3 7 58 18 8 4 0 4 18 67 3 2 6 2 1 2 4 4 1 4 2 2 8 8 4 2 2 7 10 1 11 2 3 3 10 4 12 4 6 5 4 1 2 8 13 80 31 10 8 2 2 4 1 3 12 4 2 4 7 7 2 1 2 8 3 1 3 5 2 10 3 5 6 9 6 4 4 8 8 3 4 3 3 6 18 5 8 3 1 1 1 2 1 2 3 19 3 1 2 2 1 8 3 7 71 7 7 11 100 11 4 4 0 3 1 5 70 23 5 1 0 2 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 2 2 1 2 3 2 1 2 2 2 2 1 3 2 1 2 4 4 9 9 8 10 21 21 5 16 6 3 3 6 40 5 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 87 86 d 1H J 16 \| 80 79 d 1H J 21 \| 78 78 dd 1H J 21 78 \| 65 65 d 1H J 78 \| 43 42 q 2H J 71 \| 42 41 qtd 1H J 18 57 77 \| 41 40 t 1H J 59 \| 38 38 dt 1H J 58 104 \| 36 35 dt 1H J 56 104 \| 13 12 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(-n2nc(C)cc2C)c(O)c1	ir: 4 4 8 8 15 11 9 7 9 9 23 11 9 4 2 1 1 4 4 3 2 4 4 6 4 2 2 2 1 1 1 0 1 1 1 1 1 1 2 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 4 2 6 1 1 1 1 2 2 1 1 1 1 5 2 7 1 2 2 1 5 7 4 3 3 3 4 3 6 6 7 3 3 1 2 2 1 2 2 7 2 3 1 1 0 1 3 6 5 5 2 1 1 1 1 1 0 1 1 1 1 5 2 4 5 2 0 1 1 2 15 2 0 1 1 1 2 3 2 4 10 5 1 0 0 1 1 8 0 1 4 6 6 3 1 1 1 3 1 0 1 4 4 1 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 27 9 34 27 3 2 5 14 100 65 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 1 0 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 88 88 s 1H \| 78 77 dd 1H J 20 82 \| 77 76 d 1H J 82 \| 75 74 d 1H J 21 \| 61 61 d 1H J 9 \| 39 39 s 3H \| 23 23 s 3H \| 19 19 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc2c(-c3ccc(-c4ccccc4)cc3)c(C(OC(C)(C)C)C(=O)O)c(C)cc2n1	ir: 2 2 3 2 1 1 3 3 5 7 8 11 19 6 10 16 20 9 10 33 16 87 36 28 12 10 8 2 4 10 14 8 1 3 8 3 3 10 9 13 10 54 15 6 6 4 4 24 21 4 3 2 3 9 15 12 35 9 5 2 3 8 7 7 9 21 7 8 2 19 20 33 7 4 7 3 18 37 100 28 18 13 6 8 4 5 6 7 3 11 10 6 3 5 4 7 5 7 2 3 7 7 5 10 2 4 1 1 3 7 1 2 2 1 0 4 3 4 6 17 8 3 5 3 3 11 5 7 7 7 9 5 10 4 4 11 8 7 2 7 16 4 60 13 23 7 4 11 3 9 32 10 6 2 15 4 3 22 5 7 2 1 1 1 3 13 2 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 2 1 3 3 2 1 2 2 2 1 1 4 3 4 5 10 18 13 56 65 58 15 8 5 5 6 2 1 10 40 11 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1; 1HNMR: 81 81 d 1H J 80 \| 77 77 m 2H \| 77 76 m 2H \| 76 76 m 4H \| 75 74 m 2H \| 74 73 ddt 1H J 14 64 80 \| 73 72 m 1H \| 57 57 s 1H \| 27 27 d 3H J 7 \| 25 24 s 3H \| 12 12 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccccc1N1CCc2c(Cl)nc3c(OC(F)(F)F)cccc3c21	ir: 8 4 2 3 8 3 5 3 1 2 2 2 0 4 6 3 6 3 2 3 1 2 3 22 3 2 2 6 1 2 2 2 2 2 2 1 5 4 2 1 2 4 100 12 9 58 25 5 3 4 2 0 4 3 2 35 3 4 2 0 2 4 1 0 2 3 2 3 5 5 2 1 3 6 6 1 3 2 2 0 6 6 4 6 6 3 1 1 3 3 12 2 4 2 12 2 17 61 23 5 3 7 8 15 8 6 3 3 4 14 4 3 11 8 6 5 4 2 1 2 4 45 2 3 3 2 1 2 4 3 2 5 3 3 0 3 7 5 18 3 2 1 3 9 3 4 10 22 21 7 9 3 4 59 5 11 2 1 3 5 4 2 1 1 6 0 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 2 1 1 2 2 1 1 2 2 1 4 2 2 2 2 3 4 3 27 8 5 64 20 32 22 4 3 3 2 1 2 2 2 1 2 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 78 78 dd 1H J 13 90 \| 75 74 dd 1H J 80 91 \| 74 73 dd 1H J 13 79 \| 72 71 m 2H \| 71 70 m 1H \| 69 69 dd 1H J 19 67 \| 43 42 t 2H J 49 \| 33 32 dt 1H J 48 167 \| 32 31 dt 1H J 48 168 \| 22 22 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1CCC(c2cncc(Br)c2)C1	ir: 4 5 4 8 25 17 16 11 12 7 29 15 8 2 3 1 2 4 3 5 2 1 1 1 1 1 2 2 1 14 22 5 10 12 40 4 2 4 7 2 1 1 1 3 1 1 1 3 3 2 1 1 2 4 2 1 2 3 3 2 2 2 4 7 1 6 5 24 2 2 1 0 1 1 1 2 1 3 21 5 1 1 1 1 1 1 1 1 7 2 3 2 2 3 1 3 2 2 1 1 1 2 3 4 13 16 2 4 5 28 33 14 27 29 12 28 14 9 3 100 2 5 9 5 7 2 3 6 4 15 18 35 15 25 6 2 2 1 1 1 1 1 0 1 1 0 1 2 3 0 33 81 10 7 3 8 46 3 4 9 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 5 1 2 2 7 3 4 3 3 5 6 6 23 47 16 4 30 6 5 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 86 86 t 1H J 17 \| 83 83 m 1H \| 76 75 dt 1H J 10 21 \| 41 40 ddd 1H J 8 39 114 \| 38 37 m 1H \| 37 36 ddd 1H J 51 69 122 \| 36 34 m 3H \| 24 23 m 1H \| 21 20 ddt 1H J 52 72 125 \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CSc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(C#N)cc2)cc1	ir: 2 2 0 1 2 1 1 1 2 2 1 3 3 2 1 1 2 1 1 2 3 1 3 2 1 1 1 2 3 4 2 2 2 2 2 4 1 1 2 3 1 1 1 2 1 1 1 2 2 1 1 2 2 3 3 9 12 26 4 5 1 0 1 2 1 0 1 2 2 4 5 4 11 7 2 1 1 1 1 2 4 7 2 2 2 1 2 3 1 2 2 2 1 1 2 1 2 3 100 9 2 1 2 5 1 1 2 2 1 1 2 2 0 4 10 4 5 5 4 2 1 4 5 6 2 7 2 1 1 2 2 2 4 3 2 2 1 1 1 1 3 7 2 1 1 3 21 49 11 5 4 2 7 3 1 3 3 2 1 1 1 2 1 0 2 2 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 2 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 2 1 2 4 7 4 14 27 17 22 11 4 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 77 77 m 4H \| 73 73 m 2H \| 72 72 q 1H J 17 \| 25 25 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@@H]1CN(c2ccc(C#N)cn2)CC[C@@H]1n1c(=O)[nH]c2cnc3[nH]ccc3c21	ir: 1 6 10 7 5 5 9 5 22 19 5 6 3 5 18 18 6 3 2 2 2 17 8 6 6 2 73 68 15 12 3 4 3 7 6 8 10 34 91 21 15 7 7 14 17 10 7 2 4 6 5 4 7 18 48 5 5 4 2 3 3 3 2 2 3 7 3 3 5 3 46 3 4 4 2 4 4 3 3 3 6 5 12 4 4 15 17 4 4 7 4 6 27 4 9 13 5 4 2 4 7 4 4 6 1 16 7 4 4 12 15 17 8 6 4 4 3 8 7 7 5 6 8 20 7 5 15 5 4 2 4 5 4 5 4 6 4 46 10 17 48 30 9 19 9 6 5 4 6 26 4 13 25 100 6 8 72 3 9 99 14 2 3 8 4 0 2 4 2 0 2 4 2 0 2 4 2 0 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 2 2 2 2 3 2 2 3 2 1 2 2 2 1 2 3 3 2 2 3 4 4 3 4 2 2 4 7 6 4 8 10 5 18 11 24 8 8 14 5 4 3 3 2 2 2 2 3 4 4 3 2 3 4 8 6 20 47 27 40 35 22 6 4 3 4 4 2 2 2 3 2 2 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2; 1HNMR: 99 98 s 1H \| 87 87 d 1H J 19 \| 87 87 s 1H \| 78 77 dd 1H J 19 74 \| 74 74 dd 1H J 53 64 \| 68 67 d 1H J 75 \| 66 66 d 1H J 53 \| 45 44 ddd 1H J 40 53 68 \| 38 38 ddd 1H J 57 84 142 \| 37 36 dd 1H J 64 128 \| 36 34 m 2H \| 23 22 dddd 1H J 57 68 84 117 \| 22 21 m 1H \| 20 19 dddd 1H J 40 58 86 119 \| 10 10 d 3H J 79	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1cc(C(=O)NC(C(N)=S)c2ccco2)cn1	ir: 3 4 1 1 2 2 3 1 2 2 1 2 2 2 2 4 2 1 2 2 2 3 6 16 17 4 3 3 5 4 7 4 2 1 1 2 6 2 3 6 5 5 3 5 16 8 2 2 1 1 1 2 2 4 2 3 2 1 2 2 1 1 1 2 1 0 7 7 4 2 2 2 1 1 1 4 2 6 2 2 1 1 3 4 1 2 2 2 1 2 11 2 2 1 2 2 2 1 2 2 1 2 2 2 2 1 2 1 1 1 2 2 1 1 2 2 3 5 4 3 2 2 2 2 1 2 3 14 5 1 3 3 1 1 2 2 2 1 2 2 13 6 2 3 12 11 2 6 4 2 2 5 6 5 3 4 7 24 14 3 3 3 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 2 1 1 2 1 1 2 2 3 3 2 2 1 1 2 2 3 5 9 3 3 3 2 2 1 2 2 1 1 2 2 1 5 46 3 2 3 3 3 11 11 3 3 3 3 14 100 7 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 81 81 d 1H J 79 \| 79 79 s 1H \| 79 79 s 1H \| 74 74 d 3H J 30 \| 66 65 m 1H \| 64 64 dd 1H J 16 52 \| 52 52 dd 1H J 7 79 \| 40 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(C(=O)C(NC(=O)OC(C)(C)C)c2ccc(Cl)c(Cl)c2)cnc1OC1CCOCC1	ir: 6 3 3 4 5 5 2 4 2 1 3 2 2 2 1 1 1 2 1 1 1 1 7 1 4 8 5 12 4 4 55 26 17 3 20 8 46 5 13 6 12 5 5 2 3 6 2 1 1 1 1 2 4 7 21 3 2 5 4 4 2 3 1 3 1 2 8 9 8 2 1 2 3 2 2 4 3 3 2 1 3 2 2 1 1 1 2 7 5 10 4 14 3 1 1 1 11 3 6 3 2 2 5 5 1 1 2 4 3 3 1 1 3 3 4 4 1 7 7 9 8 6 3 4 3 25 22 13 40 25 15 14 5 3 4 9 4 3 1 2 3 8 7 2 11 83 37 6 18 31 3 2 2 3 3 6 11 2 2 1 11 7 7 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 1 1 2 2 1 2 1 1 1 4 2 1 3 1 4 8 15 13 7 100 16 7 1 2 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 1 2 3 2 5 46 3 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 87 86 d 1H J 16 \| 80 80 m 1H \| 76 76 dd 1H J 7 22 \| 76 75 d 1H J 81 \| 74 73 m 1H \| 65 64 d 1H J 79 \| 60 59 dd 1H J 9 79 \| 49 48 p 1H J 54 \| 38 37 ddd 2H J 37 63 112 \| 37 36 ddd 2H J 37 63 112 \| 23 22 dddd 2H J 37 54 64 141 \| 22 22 s 3H \| 20 19 dddd 2H J 37 54 64 141 \| 14 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(CC)Cc1ccc(N)cc1C(F)(F)F	ir: 20 38 35 20 24 16 10 11 9 7 8 9 11 4 2 4 4 4 2 6 3 3 6 2 2 2 2 3 3 2 2 3 6 3 3 3 9 3 2 1 3 2 2 4 2 3 2 2 3 4 5 3 4 3 11 16 5 3 2 2 3 2 3 2 2 3 3 15 5 3 3 3 3 9 8 2 2 2 3 19 48 3 3 2 2 2 2 2 4 2 6 10 11 4 4 3 5 18 45 48 11 11 7 3 6 5 3 2 2 2 5 7 2 2 3 2 4 3 4 3 4 3 2 2 2 2 2 3 2 2 3 2 3 6 4 3 2 2 2 2 1 2 2 3 3 2 2 2 2 4 3 2 3 6 36 43 89 31 3 2 4 3 3 4 28 0 1 3 2 0 1 2 1 1 2 2 2 1 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 1 2 1 1 2 2 1 2 2 2 2 2 2 2 2 1 2 2 3 3 3 2 2 4 5 5 4 39 6 3 3 3 2 1 2 2 1 1 1 2 1 1 2 3 4 18 28 5 2 2 1 1 2 2 1 1 6 100 32 7 2 2 2 2 1 1 2 2 2 2 1 2 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 2 2 2 2 2 2 2 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 71 70 dt 1H J 9 78 \| 70 69 dq 1H J 9 20 \| 66 66 dd 1H J 21 78 \| 50 50 s 2H \| 38 37 d 2H J 9 \| 27 26 q 4H J 67 \| 11 10 t 6H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CN	ir: 1 6 19 10 7 13 5 5 4 12 25 14 4 6 3 3 2 5 5 3 2 2 2 1 1 3 3 1 1 2 2 1 1 3 3 17 12 9 6 5 2 3 5 1 2 2 2 2 2 2 3 1 2 2 3 10 11 14 5 1 4 14 19 6 19 6 3 12 15 7 5 8 6 12 7 9 66 77 38 14 10 15 8 4 5 3 3 4 6 3 2 3 3 2 3 7 2 5 1 2 2 3 3 2 2 3 1 3 3 3 2 2 8 18 19 7 1 8 8 11 5 9 13 3 5 50 26 21 16 15 18 13 29 36 19 6 8 5 2 2 2 6 21 16 11 7 2 5 1 3 23 100 9 1 1 3 2 1 2 4 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 3 2 2 2 3 2 1 2 3 2 1 3 16 9 13 21 8 11 11 12 3 4 6 5 8 7 5 5 6 11 16 14 23 33 27 36 19 6 6 15 63 56 10 5 5 4 2 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 38 38 dd 1H J 13 109 \| 35 34 m 2H \| 31 30 dtd 1H J 31 68 110 \| 28 27 m 1H \| 25 25 t 2H J 67 \| 16 15 dq 1H J 52 60 \| 15 14 s 8H \| 12 11 m 2H \| 11 10 dt 1H J 57 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)N1CCC(Nc2ccccn2)CC1	ir: 5 5 1 4 6 11 1 8 8 9 17 11 3 3 3 5 5 4 3 2 3 2 2 1 3 1 1 1 1 2 2 2 9 3 2 3 4 7 44 23 6 3 1 1 1 2 1 1 1 1 2 2 6 10 9 4 4 5 2 1 2 3 2 1 4 4 2 1 1 2 4 2 1 1 3 2 2 1 2 2 2 2 5 1 1 2 2 1 1 1 1 1 1 1 8 1 2 1 1 2 2 1 1 1 1 2 7 2 2 3 2 3 8 16 8 6 6 7 10 9 5 5 4 4 6 3 3 2 2 2 1 2 2 3 7 6 8 5 36 4 10 25 9 4 4 1 1 2 7 10 28 17 4 2 5 2 1 0 100 5 4 4 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 3 2 2 2 2 2 17 16 3 8 19 16 3 2 3 2 1 2 1 1 1 1 1 1 1 2 1 2 1 1 2 13 14 9 21 27 9 6 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 82 81 dd 1H J 17 43 \| 76 75 ddd 1H J 17 70 79 \| 66 65 m 2H \| 56 56 d 1H J 73 \| 41 40 q 2H J 66 \| 40 39 dp 1H J 50 75 \| 37 36 ddd 2H J 58 85 130 \| 34 33 ddd 2H J 59 86 130 \| 21 20 dddd 2H J 48 59 86 132 \| 19 18 dddd 2H J 48 59 86 130 \| 12 12 t 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNc1cc(-c2ccc(F)c(C)c2C)nc(N)n1	ir: 15 5 7 3 4 2 6 3 4 4 4 4 5 4 7 4 3 3 3 3 5 3 2 8 6 3 3 3 4 3 2 3 2 2 2 13 17 31 13 32 9 5 4 3 5 4 2 3 3 1 3 2 3 3 11 3 3 2 2 1 2 1 3 4 4 8 11 3 3 3 5 3 2 2 2 2 2 2 2 1 2 1 1 2 1 1 1 1 1 1 1 1 2 2 2 5 2 1 1 1 1 1 2 5 3 5 5 1 2 1 2 2 2 2 3 4 2 3 5 3 3 2 2 2 2 3 4 2 3 2 4 3 2 2 2 2 2 5 16 12 6 9 13 18 11 14 77 34 27 7 6 8 8 2 3 2 5 16 5 4 37 87 9 0 2 2 2 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 1 1 1 2 1 2 2 2 1 2 3 3 5 7 10 10 9 3 2 3 3 2 2 2 2 3 2 2 2 2 2 3 8 30 6 7 4 15 19 23 4 3 2 2 13 100 5 2 2 2 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 73 72 dd 1H J 51 86 \| 70 69 dd 1H J 87 101 \| 65 65 s 1H \| 59 58 q 1H J 47 \| 59 59 s 2H \| 30 29 d 3H J 48 \| 23 23 d 3H J 35 \| 22 22 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O	ir: 7 5 4 6 5 9 7 4 4 13 14 33 36 27 46 48 13 12 20 32 99 100 16 11 10 15 3 7 8 7 4 6 7 10 5 6 7 1 4 3 2 2 3 3 1 4 3 4 2 1 2 2 2 2 3 6 10 3 5 4 1 4 3 1 1 1 1 1 1 2 1 3 3 3 5 24 13 23 43 31 11 6 10 5 8 10 15 5 5 3 6 6 3 5 2 4 6 1 4 5 8 5 5 6 12 10 23 23 9 18 30 8 6 5 5 6 11 14 2 7 13 2 5 4 3 4 3 7 5 14 8 42 11 3 6 12 12 4 3 4 2 2 3 2 9 17 13 11 5 4 29 33 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 4 1 2 4 5 3 6 2 6 4 2 6 18 17 7 1 0 1 2 0 0 0 1 1 2 31 50 18 5 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 47 46 ddt 1H J 19 40 60 \| 44 43 ddt 1H J 17 41 59 \| 37 35 m 3H \| 35 34 m 1H \| 22 21 m 2H \| 21 18 m 7H \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)[C@@H]1CCCN1C(=O)CCc1ccccc1	ir: 3 3 3 1 2 1 1 3 2 4 0 1 1 2 5 10 2 3 2 2 4 4 2 2 2 1 1 2 2 1 24 25 13 4 11 5 2 1 2 7 30 8 8 2 2 2 1 2 1 0 1 1 1 1 3 2 4 1 3 2 5 5 1 2 2 0 1 2 2 6 3 2 1 0 5 5 2 2 7 2 0 0 1 1 0 1 1 1 6 4 3 3 2 2 2 2 2 3 5 2 1 1 3 4 4 3 5 15 15 4 4 3 8 5 4 3 4 5 4 2 0 3 4 7 1 2 2 2 3 2 3 3 1 3 5 40 5 2 3 2 1 10 7 19 19 4 14 100 1 3 2 4 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 3 6 4 3 2 2 6 5 3 41 18 7 9 83 14 12 2 2 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 73 72 m 3H \| 72 71 ddt 2H J 9 15 75 \| 45 45 tt 1H J 19 61 \| 37 37 s 2H \| 36 36 m 1H \| 35 34 m 1H \| 29 28 m 2H \| 26 25 m 2H \| 23 22 ddt 1H J 47 74 122 \| 21 18 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1OC2(c3ccc(Cl)cc31)c1nc(N3CCOCC3)sc1C(=O)NCC2I	ir: 6 5 1 12 3 3 3 4 9 7 3 3 3 6 1 1 1 2 3 6 13 5 1 1 4 3 3 12 4 4 6 9 5 13 24 26 100 43 5 8 2 5 7 3 2 0 1 1 1 0 3 5 2 2 6 8 8 22 2 1 2 1 1 4 2 5 3 12 4 1 3 4 14 2 9 5 1 0 1 3 1 4 5 2 3 3 9 7 2 4 4 3 1 12 5 3 2 2 5 5 6 1 2 1 1 6 2 3 7 7 4 12 9 9 7 7 25 48 16 5 4 6 6 3 5 16 15 10 4 12 32 4 1 2 3 11 46 4 0 1 2 19 6 1 2 3 4 30 5 1 2 19 4 16 59 9 1 1 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 1 0 1 1 1 1 3 5 2 2 2 2 6 5 2 5 12 9 14 28 11 7 6 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 5 6 30 24 6 3 2 4 5 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 83 t 1H J 48 \| 80 79 d 1H J 24 \| 74 74 d 1H J 81 \| 74 73 dd 1H J 24 82 \| 46 45 t 1H J 52 \| 43 43 dt 1H J 49 121 \| 41 40 dt 1H J 50 121 \| 39 38 m 4H \| 36 36 m 3H \| 36 35 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)NCCC[C@@H](CC(=O)O)NC(=O)OCc1ccccc1	ir: 7 5 3 5 5 4 5 3 5 6 10 6 3 5 6 3 4 5 21 5 1 100 9 11 24 7 6 9 81 14 8 12 11 7 29 18 6 4 17 11 18 8 4 6 5 2 3 4 4 2 3 5 3 1 3 5 3 1 2 3 2 2 3 3 2 2 11 6 3 4 4 5 3 1 3 5 5 4 24 4 5 4 3 3 3 3 6 7 4 7 4 3 2 2 3 3 2 6 5 6 4 3 3 3 1 3 4 4 6 3 7 3 2 4 6 6 15 4 6 7 4 7 8 9 4 4 5 17 6 15 5 5 3 3 5 5 3 3 3 3 6 6 9 64 30 43 18 0 2 58 4 5 3 3 2 2 2 3 3 2 2 3 2 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 3 3 3 3 3 6 7 2 3 4 3 2 5 4 14 3 6 19 7 2 2 3 2 2 3 3 3 9 3 3 2 2 2 3 3 3 3 3 3 7 9 34 27 11 7 4 3 2 3 3 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 74 73 m 6H \| 60 60 d 1H J 88 \| 51 51 s 2H \| 49 49 t 1H J 52 \| 39 38 dtt 1H J 61 76 89 \| 31 30 m 2H \| 26 25 dd 1H J 75 168 \| 24 23 dd 1H J 75 168 \| 18 14 m 5H \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1cc(-c2nn(C(C)C)c(N)c2C#N)ccc1OC	ir: 64 28 10 6 3 6 4 7 7 23 24 9 7 5 5 4 3 5 6 6 4 6 3 2 6 6 4 2 3 3 3 3 2 5 4 2 3 9 23 21 24 14 7 3 4 3 3 1 2 4 3 2 2 6 8 9 4 3 4 1 2 2 5 2 5 3 3 1 5 4 5 10 5 4 15 29 9 10 3 2 2 1 1 2 3 3 3 6 6 10 17 9 5 3 1 1 2 1 2 1 2 2 1 1 2 2 1 2 3 1 1 2 2 3 3 2 4 5 3 4 4 3 2 3 5 1 3 5 5 5 3 11 35 28 10 2 8 7 4 2 2 5 14 19 8 8 2 12 19 2 4 12 13 4 8 3 2 4 13 68 30 2 1 5 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 3 1 0 1 2 1 0 1 2 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 1 1 2 2 1 1 2 1 0 2 2 3 1 1 2 2 1 2 2 2 2 2 4 6 11 15 11 20 27 12 9 6 2 3 3 3 1 2 2 1 1 1 2 1 1 3 54 70 3 2 2 0 0 2 2 0 1 8 100 83 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 75 74 dd 1H J 17 89 \| 73 72 d 1H J 17 \| 70 69 d 1H J 89 \| 47 46 p 1H J 48 \| 42 41 q 2H J 63 \| 39 38 s 2H \| 23 23 s 2H \| 15 14 d 6H J 48 \| 14 14 t 3H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Fc1c(Cl)cc(Cl)cc1C1(C(F)(F)F)CCN(Cc2ccccc2)C1	ir: 5 10 4 2 3 4 2 2 2 2 1 7 1 1 2 4 1 1 1 2 1 3 2 5 4 1 1 1 3 2 7 17 8 2 3 3 6 13 10 25 100 4 3 6 3 2 2 2 2 11 4 2 3 4 6 2 3 3 1 0 1 3 1 11 5 26 23 21 16 16 3 3 4 2 2 4 35 9 34 21 1 1 1 2 2 2 3 1 7 42 19 6 9 6 5 5 4 34 23 9 52 11 14 41 13 25 26 5 19 9 3 2 1 3 2 1 2 2 4 8 4 6 10 3 4 2 3 2 6 4 3 5 8 6 10 53 5 2 2 2 1 2 14 18 3 2 9 2 1 2 1 0 4 2 2 3 1 1 1 2 10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 2 5 4 4 1 1 1 3 9 14 9 18 67 33 32 3 2 2 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 75 dd 1H J 22 33 \| 73 72 m 5H \| 72 72 dd 1H J 22 31 \| 37 36 m 1H \| 36 36 s 1H \| 36 35 d 1H J 124 \| 34 34 m 1H \| 30 30 ddd 1H J 18 37 121 \| 28 28 ddd 1H J 18 38 121 \| 24 23 dtd 1H J 25 44 106 \| 21 20 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)CCOc1c2[nH]c3ccc(Cl)cc3c2c(N2CCCC2)c2c1[nH]c1ccc(Cl)cc12	ir: 8 7 3 5 46 14 1 5 15 2 1 6 4 4 3 3 17 11 5 10 2 3 3 2 12 7 4 6 2 7 4 2 2 6 26 7 2 3 2 1 3 3 3 2 7 10 2 1 12 5 12 20 63 100 38 6 8 3 6 6 4 2 2 3 6 5 6 15 7 25 5 3 2 1 4 10 9 6 6 2 2 3 2 9 3 4 3 35 4 9 7 25 5 8 4 3 3 5 8 49 49 6 4 3 1 4 7 21 4 11 6 33 3 3 2 4 4 2 4 33 4 4 3 3 3 3 1 4 15 97 7 1 0 8 36 11 9 4 2 2 2 4 2 1 1 2 3 4 2 3 5 16 16 6 3 1 2 1 1 4 40 11 14 5 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 2 1 2 1 2 2 2 3 3 4 3 3 2 3 2 5 16 3 18 32 39 60 15 19 2 3 2 2 2 2 2 2 1 1 4 2 2 3 2 7 7 8 7 7 17 58 56 68 26 8 4 3 4 2 2 1 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 98 98 s 2H \| 79 79 d 2H J 26 \| 75 74 d 2H J 73 \| 72 72 dd 2H J 26 73 \| 44 43 t 2H J 66 \| 37 36 td 4H J 19 36 \| 31 30 t 2H J 66 \| 25 25 s 5H \| 20 20 p 4H J 20	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(C(=O)Cl)cc1OC(F)(F)F	ir: 5 8 4 4 14 7 5 3 4 4 3 5 13 9 2 3 4 2 2 4 4 5 5 5 6 4 5 23 28 7 6 5 6 9 7 5 8 6 4 5 4 5 4 3 2 1 2 3 2 1 2 3 4 4 19 16 3 4 2 2 2 4 3 7 3 3 2 2 3 8 4 3 2 2 2 2 2 3 5 2 2 2 2 2 2 2 2 2 6 5 11 33 9 8 3 4 8 20 100 88 22 91 28 7 5 8 4 4 2 8 26 17 1 3 3 2 1 3 3 2 2 2 3 4 3 5 44 13 6 3 3 2 3 2 3 5 7 22 86 7 0 5 3 17 4 4 3 0 2 4 15 33 7 7 5 4 2 3 2 0 1 3 2 2 2 3 2 0 2 3 2 0 2 3 2 0 2 3 1 0 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 2 2 3 2 3 3 6 7 9 28 70 21 3 4 4 2 1 3 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1; 1HNMR: 80 79 d 1H J 20 \| 78 77 dd 1H J 20 88 \| 71 71 d 1H J 88 \| 39 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1oc(-c2ccccc2)nc1C	ir: 4 5 9 4 4 2 3 3 2 4 3 2 4 6 5 1 1 2 3 4 6 5 2 2 2 3 4 3 4 5 8 26 18 21 23 4 4 5 4 3 7 15 16 0 3 3 2 1 1 2 1 0 1 2 2 1 2 3 1 1 2 2 1 0 3 2 3 8 10 7 2 0 3 4 4 2 5 6 5 3 3 2 1 1 5 7 2 2 2 4 13 30 6 3 1 2 2 2 2 1 2 2 8 7 2 2 2 3 10 5 4 3 3 2 1 2 4 4 2 12 9 32 25 7 12 6 11 5 8 6 3 3 2 2 7 36 26 8 5 3 4 5 7 8 56 6 5 13 7 10 11 19 18 2 1 2 1 1 1 1 1 1 1 1 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 2 1 0 1 2 2 1 1 2 2 0 1 3 2 1 3 6 4 3 13 20 47 100 30 13 5 9 8 4 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 80 79 m 2H \| 75 74 m 3H \| 39 39 s 3H \| 25 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccnc1-c1n[nH]c(-c2cc(C(C)(C)C)ccc2O)n1	ir: 2 2 5 6 2 3 4 3 2 4 4 8 10 12 18 9 14 24 17 5 12 9 20 26 18 8 18 16 18 9 17 28 19 21 11 51 41 55 92 73 56 85 18 11 6 6 3 2 3 4 6 7 15 44 42 12 7 10 4 4 4 12 6 7 2 3 2 17 16 8 6 5 5 1 4 7 15 8 39 73 21 11 13 33 13 15 14 12 4 4 3 5 10 5 22 23 21 3 2 14 5 4 8 51 48 98 42 21 12 5 4 2 2 2 6 9 4 10 6 34 20 6 15 7 10 8 5 8 21 5 15 13 5 8 7 16 11 6 15 14 3 3 2 3 6 20 15 5 3 5 6 23 10 10 47 11 25 5 3 2 2 2 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 2 2 1 2 3 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 1 1 1 1 1 1 1 1 1 1 2 2 3 4 3 2 1 2 2 2 2 2 2 2 3 3 4 9 28 25 87 52 16 7 11 16 36 55 19 15 4 3 4 1 0 4 10 21 100 85 32 4 4 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 91 91 s 1H \| 86 86 dd 1H J 21 39 \| 81 80 ddt 1H J 8 16 78 \| 76 75 d 1H J 24 \| 73 72 ddd 3H J 31 81 159 \| 69 69 d 1H J 88 \| 25 24 d 3H J 8 \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc2c(c1C1=NC(C)(C(C)C)C(=O)N1)OCO2	ir: 2 4 14 3 23 10 6 5 4 1 2 2 9 4 6 7 3 3 27 6 6 16 7 2 5 3 3 3 16 10 7 12 26 10 32 47 4 8 8 4 3 16 2 3 2 0 1 1 0 1 1 2 8 8 14 5 1 1 1 3 1 2 2 1 2 57 2 3 2 3 42 0 2 2 2 2 3 3 4 1 1 6 2 2 0 1 1 2 13 2 1 1 1 0 1 2 5 13 1 5 1 0 1 1 0 1 2 2 13 8 4 9 4 4 3 2 8 23 20 38 22 5 6 4 0 3 4 50 6 5 1 3 1 2 1 1 1 3 3 13 13 21 9 3 1 1 4 10 10 2 5 3 6 100 47 10 9 33 4 3 10 10 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 1 0 0 0 0 1 1 2 2 1 5 4 13 10 15 11 8 6 5 4 1 1 1 0 0 1 1 1 1 1 1 2 1 1 2 2 3 6 42 63 35 15 5 1 1 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 91 91 s 1H \| 77 76 d 1H J 90 \| 71 71 d 1H J 90 \| 61 60 d 1H J 15 \| 60 60 d 1H J 15 \| 39 39 s 2H \| 22 21 m 1H \| 16 15 d 3H J 14 \| 10 10 d 3H J 75 \| 10 10 d 3H J 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)Cc1cc(C(=O)C(C)Br)ccc1OC	ir: 7 5 4 6 6 3 2 2 2 2 1 1 3 1 3 2 4 2 2 3 5 8 4 15 10 2 3 3 2 1 0 1 2 0 3 5 5 5 10 15 14 62 5 2 2 2 1 3 2 3 2 3 2 1 12 14 4 3 1 0 2 3 4 14 22 4 2 4 5 13 2 5 8 3 3 2 2 3 3 1 0 1 1 1 1 1 2 3 3 4 8 9 6 5 2 4 2 4 8 4 3 8 9 14 2 2 1 2 1 1 0 1 2 3 3 7 18 20 9 24 29 12 3 5 4 14 7 5 0 4 6 6 7 3 4 1 2 1 3 3 10 94 40 11 7 29 8 4 3 2 9 7 4 7 4 3 6 2 1 0 1 1 1 2 0 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 0 1 1 2 2 1 1 1 2 4 5 4 6 8 8 9 6 18 26 27 16 100 26 10 4 2 1 1 1 1 1 1 1 1 0 0 0 1 0 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 79 79 dt 1H J 9 19 \| 79 78 dd 1H J 20 84 \| 70 69 d 1H J 86 \| 52 51 q 1H J 72 \| 39 38 s 2H \| 37 36 m 5H \| 18 17 d 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(Nc2cccc(NC(=O)c3ccc(N)cc3)c2)nc(N)n1	ir: 10 10 9 14 5 4 4 2 5 4 5 2 1 3 9 4 2 3 4 4 4 7 13 3 2 2 2 1 2 4 2 4 3 9 8 4 15 21 10 6 19 22 9 9 10 9 9 37 16 6 3 1 2 3 2 2 6 10 4 2 3 4 2 1 2 7 8 10 7 4 2 2 2 4 1 4 2 6 5 3 2 3 2 1 1 1 0 1 2 3 2 1 2 4 1 2 1 1 0 8 2 1 3 6 7 2 15 13 6 3 1 1 3 1 1 2 1 1 1 1 2 1 0 1 2 1 3 3 3 1 0 1 9 1 0 2 2 2 2 5 10 4 7 22 30 59 16 18 14 11 4 7 5 8 7 16 15 25 13 48 4 5 6 12 15 3 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 0 1 2 2 1 1 2 2 2 3 1 14 6 27 10 5 2 2 2 1 1 2 3 1 0 2 3 2 1 6 100 26 11 5 3 29 60 13 5 9 9 12 35 97 9 5 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 94 94 s 1H \| 83 83 s 1H \| 78 78 m 2H \| 75 74 ddd 1H J 13 22 75 \| 74 74 ddd 1H J 14 22 79 \| 74 73 m 1H \| 69 69 t 1H J 21 \| 66 66 m 2H \| 61 61 s 1H \| 57 57 s 2H \| 46 45 s 2H \| 22 21 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CC1(OC(C)=O)CCC(C)(C)c2ccc(Br)cc21	ir: 7 8 12 9 9 10 7 8 8 8 7 7 7 7 7 6 7 12 23 7 6 7 8 7 8 8 8 11 7 15 6 6 6 6 6 6 6 6 6 6 6 7 7 7 6 6 6 6 7 6 7 7 8 7 40 5 10 9 7 9 7 7 7 7 7 10 8 18 8 15 8 7 9 8 8 15 7 7 7 6 6 6 6 6 7 8 7 7 7 7 11 8 7 7 6 7 9 8 9 12 15 12 9 9 10 7 7 8 8 7 10 11 9 8 11 10 9 14 11 11 14 19 11 22 28 16 11 11 7 14 13 14 22 10 10 7 6 8 9 6 5 10 14 0 100 26 7 12 8 7 7 9 9 10 7 8 7 5 6 7 6 6 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 7 8 9 7 8 7 8 8 14 9 10 9 8 11 11 19 43 12 25 35 14 10 10 7 8 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6; 1HNMR: 74 73 m 2H \| 71 71 d 1H J 75 \| 41 41 q 2H J 66 \| 34 33 s 0H \| 31 31 s 0H \| 25 24 ddd 1H J 57 84 143 \| 23 22 ddd 1H J 57 84 143 \| 22 21 s 3H \| 21 20 ddd 1H J 57 83 140 \| 19 18 ddd 1H J 56 82 137 \| 13 13 d 6H J 113 \| 13 12 t 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(-n2nc(CO)c3c2C(=O)N(c2ccc(-n4ccccc4=O)cc2)CC3)cc1	ir: 9 6 1 3 3 2 1 5 6 4 4 6 8 8 5 6 4 6 1 6 3 4 3 4 3 3 3 4 7 2 1 3 3 1 1 10 3 0 1 6 8 0 3 16 100 84 10 5 11 9 5 6 6 20 58 51 13 11 15 11 21 9 6 8 5 3 3 1 2 21 5 3 3 3 2 3 17 4 5 2 2 4 4 6 17 9 22 27 18 7 5 5 8 5 3 3 2 3 2 2 3 4 6 4 5 5 3 5 9 2 3 2 2 5 3 3 2 2 4 5 7 6 4 3 6 8 9 4 3 3 3 3 1 2 4 3 2 52 30 4 5 28 24 11 7 6 79 17 13 37 17 6 13 5 3 8 10 7 25 1 6 7 2 12 2 3 1 1 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 2 2 2 3 1 2 3 2 1 2 10 10 7 60 79 37 32 33 4 5 5 5 25 4 2 2 3 1 1 2 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1; 1HNMR: 77 76 m 3H \| 75 75 m 2H \| 74 73 m 2H \| 72 72 ddd 1H J 13 75 90 \| 72 71 m 2H \| 64 63 td 1H J 8 74 \| 62 61 dd 1H J 7 92 \| 48 48 d 2H J 55 \| 42 41 t 2H J 52 \| 39 38 t 1H J 54 \| 38 38 s 2H \| 32 31 td 2H J 21 51	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(O)CN1CC(C)C2OC(C)(C)OC2C1	ir: 4 9 11 9 7 6 10 11 0 15 17 3 14 20 14 9 7 13 6 5 3 2 2 3 8 2 2 1 3 1 1 2 1 2 1 2 1 6 1 2 1 1 2 1 1 2 2 1 1 6 2 2 4 1 3 2 3 3 10 18 4 5 7 4 2 2 2 4 15 9 10 5 6 17 6 17 8 7 2 2 6 11 30 18 4 3 11 24 100 74 13 10 5 14 8 7 9 17 7 11 7 17 22 4 3 5 4 5 2 4 10 3 1 4 3 2 1 2 3 4 2 3 3 2 3 3 11 6 8 3 2 2 0 2 4 2 1 4 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 3 2 1 2 1 2 2 2 3 3 3 4 3 14 18 5 2 2 2 2 2 1 1 1 10 44 7 1 1 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0; 1HNMR: 42 42 m 2H \| 39 38 qq 1H J 55 69 \| 30 30 m 2H \| 29 29 dd 1H J 48 112 \| 28 27 m 2H \| 26 26 dd 1H J 48 112 \| 26 25 dd 1H J 54 116 \| 20 19 dddd 1H J 32 57 71 100 \| 14 14 s 2H \| 13 13 s 2H \| 12 11 d 3H J 70 \| 11 10 dd 3H J 11 69	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1c2c(c3ccc(-c4cccc[n+]4[O-])cc3n1CC(F)(F)F)NN(C1CCCCO1)C2	ir: 12 9 10 12 5 15 21 16 7 20 40 24 19 21 15 7 4 6 7 4 1 7 5 3 2 8 10 26 49 28 7 9 12 7 10 15 8 15 6 12 5 6 8 25 14 100 22 7 7 17 23 9 4 20 19 16 11 8 12 1 4 7 6 9 9 7 12 18 10 19 16 12 13 5 25 8 9 5 3 3 6 27 6 5 5 13 18 3 6 4 5 3 4 7 10 21 13 4 6 5 14 17 17 60 13 10 1 6 7 6 8 20 8 13 6 20 29 54 7 19 28 12 5 8 7 7 4 4 5 5 3 11 7 7 10 10 14 13 21 54 41 18 38 17 11 6 7 24 7 15 10 67 5 3 3 14 13 4 28 5 6 2 3 3 3 12 29 12 3 0 2 4 2 0 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 1 1 2 3 1 2 2 3 1 1 2 2 1 1 2 3 1 1 2 3 2 1 3 2 2 3 3 3 2 3 4 6 8 10 10 3 5 5 6 6 11 17 44 23 72 30 25 8 7 6 4 3 2 3 3 5 3 4 4 4 2 3 3 3 7 3 4 20 67 89 54 23 9 10 9 2 2 4 3 2 3 4 3 2 2 3 2 1 1 3 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2; 1HNMR: 90 90 s 1H \| 77 77 d 1H J 84 \| 75 75 d 1H J 22 \| 74 73 dd 1H J 21 83 \| 46 45 t 1H J 43 \| 45 45 d 1H J 130 \| 45 44 d 1H J 128 \| 42 42 dd 1H J 16 59 \| 38 37 ddd 1H J 41 62 110 \| 37 36 ddd 1H J 40 61 109 \| 36 35 dd 1H J 16 52 \| 33 32 d 1H J 130 \| 32 31 d 1H J 130 \| 30 30 td 1H J 15 55 \| 27 27 td 1H J 15 53 \| 20 19 dddd 1H J 44 61 80 125 \| 18 16 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=S(=O)(c1ccccc1)c1ccc2nc(Cl)nn2c1	ir: 1 2 2 2 3 1 1 1 1 4 4 3 31 21 3 3 14 19 12 4 3 1 0 4 3 1 1 1 1 3 64 24 4 0 1 1 1 7 1 2 19 12 4 3 64 100 2 0 1 2 1 0 1 1 1 2 1 1 2 1 1 1 4 8 5 2 2 1 1 2 1 1 3 4 5 1 1 2 4 1 1 1 0 1 3 13 4 5 24 52 23 3 5 4 3 7 1 1 6 10 8 13 5 2 1 1 11 10 3 1 1 1 1 1 1 1 1 1 1 2 10 2 5 19 0 2 2 1 5 4 1 2 2 0 8 10 1 3 2 0 0 2 2 1 2 3 2 1 14 7 3 1 1 2 1 0 1 1 1 2 0 1 1 0 1 1 1 6 3 5 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 3 2 6 18 23 10 6 2 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 99 98 d 1H J 14 \| 82 82 dd 1H J 14 96 \| 80 80 d 1H J 95 \| 80 79 dq 2H J 16 86 \| 79 78 ddt 1H J 15 71 88 \| 77 77 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(CC1CO1)c1ccccc1	ir: 4 2 3 2 7 4 2 2 4 4 2 3 1 1 2 2 1 1 1 1 3 6 2 1 1 1 1 2 1 2 6 6 8 5 4 13 13 11 10 7 10 100 81 6 5 8 4 3 2 1 1 1 3 3 3 1 1 1 1 1 4 5 4 3 3 0 2 5 17 11 6 10 5 3 6 30 42 14 9 8 3 2 4 8 8 7 6 13 12 7 6 11 5 2 4 11 10 4 8 8 4 4 2 2 2 2 1 1 1 1 1 1 2 2 2 1 2 2 2 4 6 2 2 2 1 2 1 1 2 3 2 3 2 3 8 16 15 2 1 2 1 2 15 24 26 35 16 16 7 13 3 3 23 14 6 2 2 2 3 2 9 15 2 1 1 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 1 1 0 0 1 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 3 4 3 8 8 16 25 67 77 25 17 14 6 4 5 2 3 2 2 2 1 1 1 1 1 1 1 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 72 72 m 2H \| 68 68 tt 1H J 13 77 \| 67 67 m 2H \| 36 36 m 1H \| 34 33 m 2H \| 30 30 s 2H \| 28 28 m 1H \| 26 25 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Oc1ccc2c(c1Cl)OCO2	ir: 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 8 6 1 2 2 2 2 2 2 3 6 6 4 2 3 4 4 3 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 3 2 8 43 2 2 3 2 2 8 6 3 5 1 53 2 7 3 4 3 0 2 2 2 2 2 2 2 3 1 1 3 5 3 1 26 100 17 8 2 1 4 3 0 1 3 16 0 1 3 2 1 1 3 2 0 5 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 3 2 2 1 22 3 2 3 2 1 2 3 2 1 1 2 3 1 1 2 2 1 8 3 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 5 2 2 3 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 3 2 2 2 10 3 31 13 2 2 5 3 2 3 59 15 11 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 3 3 1 2 2 3 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2; 1HNMR: 77 77 s 1H \| 68 67 d 1H J 93 \| 67 66 d 1H J 93 \| 59 59 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)C[C@@](O)(CCc1ccccc1)c1ccccc1	ir: 3 3 8 1 4 4 6 3 10 8 6 9 24 10 2 6 8 6 5 33 67 21 15 8 6 7 3 2 2 0 11 11 7 1 1 2 1 5 8 7 22 20 7 5 3 1 1 2 2 2 2 2 1 0 1 1 1 1 1 1 0 1 1 1 1 1 6 5 6 5 9 4 3 1 6 15 14 15 23 15 12 9 16 22 8 4 2 2 4 13 8 3 1 1 1 6 6 6 2 3 2 2 1 1 1 1 1 1 1 0 1 1 1 2 1 4 8 9 2 1 4 1 2 1 2 2 2 2 2 4 4 4 4 6 11 12 9 4 5 7 10 8 5 34 11 6 6 5 2 1 1 1 3 2 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 1 1 2 2 2 3 3 5 2 2 3 1 1 2 3 4 3 4 19 23 100 18 31 4 3 3 4 5 45 86 41 10 4 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 1 1 1 3 1 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 75 74 m 2H \| 73 72 m 6H \| 72 71 dtd 2H J 8 15 67 \| 71 70 tt 1H J 14 64 \| 46 46 s 1H \| 31 31 s 0H \| 29 28 m 2H \| 28 27 dtt 1H J 9 81 139 \| 24 23 dt 1H J 80 150 \| 22 21 dt 1H J 81 150	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CSc1cccc(-c2ccc(S(=O)(=O)N(C)C3CCCCc4c(OCC(=O)O)cccc43)cc2)c1	ir: 3 3 5 3 3 13 5 4 5 3 2 3 11 6 4 12 21 14 10 16 30 100 10 18 6 4 4 2 1 3 8 2 1 2 8 3 1 2 3 6 16 7 3 6 2 4 14 49 7 9 4 4 1 1 3 8 9 3 5 2 1 2 2 7 4 4 4 18 11 16 3 2 3 3 4 4 7 5 14 15 6 6 6 46 38 12 19 8 41 13 8 10 24 7 5 2 3 4 3 9 5 3 3 2 2 2 0 1 2 2 3 4 4 4 1 3 3 3 4 3 6 9 4 3 3 3 12 7 4 2 0 3 3 1 2 2 3 1 2 31 37 6 5 12 7 2 4 12 10 2 1 3 4 6 3 3 2 6 4 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 2 2 1 5 4 2 1 3 4 3 5 9 12 25 70 23 8 7 8 2 1 1 1 14 11 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 79 78 m 4H \| 76 75 ddd 1H J 13 22 77 \| 75 75 t 1H J 22 \| 74 74 m 1H \| 73 72 m 2H \| 70 70 dt 1H J 9 85 \| 68 68 dd 1H J 11 81 \| 47 46 s 2H \| 41 40 m 1H \| 30 28 m 5H \| 25 25 s 2H \| 21 20 m 1H \| 19 16 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1ccc2c(c1)c1ccccc1n2CCC(=O)NCCO	ir: 3 6 3 4 4 1 7 3 5 3 3 2 1 1 1 1 2 1 1 1 1 1 2 1 1 3 1 1 2 7 5 5 4 6 3 2 2 1 1 2 2 1 4 11 5 3 1 1 0 1 1 0 3 2 16 2 1 1 1 1 1 1 1 1 1 3 2 2 10 3 0 1 2 1 8 2 1 1 1 1 8 2 1 1 1 1 2 2 7 14 19 8 6 4 5 2 1 1 1 0 1 0 1 0 0 1 3 1 0 1 3 1 3 2 2 1 1 1 2 2 12 3 2 3 4 3 2 1 0 1 2 0 1 1 1 0 1 6 3 1 0 1 15 9 2 55 25 6 3 5 1 4 2 0 4 3 5 19 8 1 2 0 1 7 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 2 1 1 1 1 3 2 1 2 2 2 2 2 3 6 3 5 3 26 10 3 2 3 1 1 12 100 14 4 2 1 1 1 1 1 1 20 11 3 4 5 3 12 7 15 3 2 4 45 12 3 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 82 81 m 1H \| 75 74 m 2H \| 74 73 m 3H \| 70 70 dd 1H J 22 81 \| 69 69 t 1H J 56 \| 48 48 s 2H \| 47 46 t 1H J 56 \| 44 43 t 2H J 62 \| 38 37 dt 2H J 48 57 \| 34 33 dt 2H J 49 56 \| 26 25 t 2H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(-n2ccc(N)n2)ccc1-c1ccc(N(C)C2CC(C)(C)NC(C)(C)C2)nn1	ir: 13 12 4 5 5 4 6 5 4 5 2 8 11 20 41 22 21 7 15 7 2 9 4 4 5 4 3 6 8 3 2 2 4 1 2 5 3 5 9 13 7 7 27 6 12 6 9 17 26 26 40 5 10 9 38 12 14 0 5 5 4 0 2 4 6 8 3 9 6 3 2 5 3 3 2 3 3 3 6 3 3 8 7 5 3 3 5 13 6 5 5 5 13 5 3 3 4 3 6 6 8 3 7 7 0 3 6 4 8 4 3 3 3 2 4 2 3 3 7 12 6 16 12 10 12 15 14 7 17 14 13 18 16 17 5 5 3 5 9 7 24 4 6 11 9 27 18 8 5 6 12 3 14 9 14 14 37 17 12 23 8 1 2 4 2 2 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 2 1 1 2 2 2 2 2 2 2 6 13 11 10 20 53 20 28 11 15 5 2 2 2 4 2 2 2 2 2 2 5 12 35 30 37 57 10 3 2 2 4 2 2 12 58 100 13 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 77 76 m 2H \| 73 73 d 1H J 22 \| 69 68 d 1H J 79 \| 62 62 d 1H J 29 \| 41 41 s 2H \| 41 40 dtdd 1H J 15 51 66 81 \| 39 39 s 3H \| 32 32 d 3H J 16 \| 20 19 dd 2H J 66 125 \| 18 17 dd 2H J 66 124 \| 16 15 s 1H \| 13 13 s 5H \| 12 11 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)Cc1ccc2oc(S(N)(=O)=O)cc2c1	ir: 5 13 4 2 1 1 1 2 1 2 1 2 4 1 1 1 2 3 1 2 0 1 7 1 1 0 0 0 0 0 0 1 0 1 1 1 0 0 1 1 1 0 1 1 1 2 3 1 1 0 1 1 4 8 2 3 1 0 1 1 0 1 2 4 7 2 5 8 2 2 1 1 2 2 2 1 3 6 4 3 10 9 10 12 34 37 39 27 13 7 7 4 2 13 5 3 3 5 4 8 9 2 7 5 1 1 1 1 1 2 1 2 3 2 3 3 19 23 35 18 9 4 3 2 3 2 1 2 1 1 0 2 4 2 0 1 1 0 0 1 1 4 1 1 1 0 0 2 0 1 2 2 1 1 1 0 0 0 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 1 1 3 2 3 3 2 3 1 1 1 1 1 1 1 0 0 1 1 1 0 2 4 98 12 5 3 8 60 100 15 4 3 1 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 76 76 s 2H \| 76 75 ddt 1H J 7 15 22 \| 74 74 d 1H J 84 \| 73 72 m 2H \| 36 36 d 2H J 9 \| 23 23 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CN(CCN2CCOCC2)c2cc(Cl)nn3c(C#N)cnc23)cc1	ir: 4 10 13 12 7 6 9 12 7 19 12 26 6 21 18 20 8 18 22 12 8 16 12 15 100 24 51 37 16 26 10 6 5 9 8 3 10 21 19 7 6 12 10 0 6 14 13 29 13 15 10 9 26 21 54 50 53 35 35 18 21 26 18 37 20 11 13 11 11 26 12 21 75 64 28 19 26 23 13 14 74 15 9 10 42 68 22 39 31 12 18 9 9 14 37 13 29 22 36 22 33 43 47 18 13 10 5 7 7 6 1 6 11 18 19 9 9 6 9 12 9 7 5 7 9 7 10 10 21 30 13 17 15 6 5 17 16 50 8 7 5 4 4 6 7 4 10 20 62 12 33 12 28 16 14 11 5 5 5 9 33 95 7 8 5 3 4 6 5 3 5 6 4 3 4 5 4 3 5 5 4 4 3 30 4 1 6 7 4 3 6 6 3 3 6 6 4 3 6 6 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 6 4 4 5 6 4 4 5 5 4 4 6 5 4 4 5 6 4 5 7 6 4 7 7 6 8 8 8 6 7 8 10 7 15 13 27 71 96 47 42 40 17 20 15 7 3 6 8 6 4 5 6 4 3 6 6 4 3 5 6 4 3 6 5 3 3 6 5 3 4 5 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 4 3 4 6 4 3 4 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 5 4 3 5 5 4 3 5 5 3 4 5 5 3 4 5 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 4 3 4 6; 1HNMR: 85 85 s 1H \| 72 72 dt 2H J 9 86 \| 69 68 m 2H \| 68 67 s 1H \| 46 46 t 2H J 9 \| 38 38 s 3H \| 37 37 m 6H \| 29 28 t 2H J 60 \| 26 25 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C#CC[C@]1(O)C=C[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@@H](c3ccc(C(C)=O)cc3)C[C@@]21C	ir: 1 2 2 2 2 2 7 3 1 3 1 1 2 1 1 1 2 2 2 3 2 3 2 3 4 6 3 2 6 3 1 1 3 6 2 1 1 2 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 1 2 1 2 13 2 2 1 1 1 1 1 2 1 2 2 2 4 3 3 3 2 2 6 6 5 2 2 6 3 1 1 1 1 1 2 1 2 10 3 2 3 1 2 3 1 2 1 1 1 3 2 3 2 2 2 4 3 3 2 2 1 1 2 2 4 4 2 2 2 2 2 9 6 2 2 2 1 1 2 1 1 2 1 2 1 10 1 21 2 2 1 2 1 1 2 1 3 1 2 9 4 1 1 1 1 1 1 1 8 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 1 1 2 1 1 2 2 2 2 2 3 2 2 2 3 3 3 8 11 7 12 5 2 2 1 3 5 1 100 11 0 2 3 2 0 1 14 2 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 73 72 m 2H \| 60 59 ddt 1H J 9 18 92 \| 59 58 ddd 1H J 18 81 90 \| 58 57 p 1H J 9 \| 39 38 m 1H \| 33 33 s 1H \| 29 29 ddd 1H J 9 26 106 \| 27 25 m 7H \| 26 26 s 3H \| 25 24 m 2H \| 24 23 td 1H J 18 82 \| 21 20 dd 1H J 52 131 \| 19 18 m 2H \| 17 16 m 1H \| 10 10 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(-n2cnc(C#N)c2)c1	ir: 5 5 2 5 10 5 1 2 4 2 0 3 4 2 0 3 4 2 0 4 5 2 2 3 4 1 3 5 4 4 4 13 8 7 7 21 24 3 3 5 21 38 5 8 5 1 15 19 15 2 2 4 3 1 3 4 6 10 4 7 4 1 4 5 3 1 3 7 6 4 7 6 4 4 6 11 15 28 5 11 6 8 5 4 3 2 9 5 2 4 9 11 5 7 12 12 3 3 6 9 3 6 12 11 5 3 4 4 3 7 10 7 6 3 5 2 0 2 4 2 0 3 9 3 3 4 9 7 5 6 4 5 2 5 5 2 1 4 6 6 32 31 16 5 4 3 4 2 1 4 3 3 10 11 18 12 2 4 3 2 6 22 10 0 2 4 3 1 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 1 2 3 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 3 2 1 2 3 2 1 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 1 2 3 2 1 3 3 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 3 3 1 2 4 4 4 4 5 5 3 5 6 4 7 6 4 4 5 5 2 7 18 100 73 72 30 10 9 5 3 4 7 3 3 4 4 2 0 3 4 1 0 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 4 2 1 2 3 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 80 80 d 1H J 17 \| 75 75 d 1H J 18 \| 73 73 ddd 1H J 14 22 64 \| 73 72 m 2H \| 71 70 ddt 1H J 10 20 72 \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
FC(F)(F)c1cc(Br)c2cc[nH]c2c1	ir: 11 7 13 21 3 7 11 5 3 12 12 5 2 7 12 8 2 7 10 6 10 29 72 25 29 12 9 3 3 9 9 3 4 10 9 3 4 9 8 3 11 10 7 2 5 10 7 1 5 10 7 1 6 11 6 1 6 11 6 1 6 10 6 2 10 36 100 53 15 14 5 2 7 9 4 2 8 9 4 5 14 16 4 3 8 8 3 3 9 8 3 8 10 8 4 6 14 24 57 5 18 30 10 9 12 8 3 22 56 44 7 6 11 6 2 8 19 8 3 6 10 5 2 7 12 20 53 18 10 5 2 7 9 4 3 8 9 4 4 10 14 11 14 19 29 7 4 11 11 4 4 9 11 21 30 12 9 3 5 11 7 0 17 36 8 2 5 10 6 1 6 10 6 1 6 11 6 2 7 10 5 2 7 9 5 2 7 9 4 3 7 9 4 3 8 8 4 3 8 8 3 4 8 8 3 4 8 7 3 4 9 7 3 5 9 7 2 5 9 6 2 5 10 6 2 5 10 6 2 6 10 6 2 6 9 5 2 6 9 5 3 7 9 5 3 7 9 4 3 7 8 4 4 8 8 4 4 8 8 4 4 8 7 3 4 8 7 3 5 8 7 3 5 9 7 3 5 9 6 3 6 10 6 3 7 13 20 24 52 28 23 10 12 12 7 4 7 10 7 4 8 9 5 3 7 8 5 4 8 9 7 20 26 22 26 36 42 10 4 5 9 7 4 5 8 7 4 5 9 7 3 5 9 6 3 6 9 6 3 6 9 6 2 6 9 5 3 6 9 5 3 6 8 5 3 6 8 5 3 7 8 5 4 7 8 4 4 7 8 4 4 7 7 4 4 8 7 4 5 8 7 4 5 8 7 3 5 8 6 3 5 8 6 3 5 9 6 3 6 9; 1HNMR: 91 90 d 1H J 66 \| 78 78 dq 1H J 9 22 \| 77 77 dp 1H J 8 24 \| 73 73 dd 1H J 37 66 \| 68 68 d 1H J 39	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(S(=O)(=O)OC2COC3(CCC(C(C)(C)C)CC3)C2)cc1	ir: 16 20 6 5 2 2 2 6 9 17 11 37 19 3 2 1 4 2 1 2 1 1 1 6 8 2 3 1 1 1 1 7 1 2 1 1 4 1 1 2 1 2 18 3 6 2 2 1 4 5 10 10 5 30 3 2 4 1 2 2 3 2 7 12 12 33 8 4 2 5 3 2 3 4 5 3 2 1 2 2 1 17 5 6 100 11 1 2 16 1 3 2 5 6 9 0 3 3 0 1 3 1 0 1 3 2 1 1 2 1 1 1 3 5 3 4 3 2 2 16 4 6 3 8 13 16 3 5 8 4 7 4 3 3 1 2 1 1 0 1 1 0 1 1 1 1 9 25 2 3 2 1 4 1 1 1 1 1 1 1 2 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 4 4 3 2 3 2 2 1 3 4 13 8 8 21 12 2 3 3 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 77 77 m 2H \| 75 74 dq 2H J 9 83 \| 53 52 tt 1H J 50 59 \| 41 40 dd 1H J 50 109 \| 38 38 dd 1H J 51 108 \| 24 24 d 3H J 10 \| 23 23 dd 1H J 59 133 \| 21 20 dd 1H J 59 133 \| 18 17 ddd 2H J 59 85 135 \| 17 16 m 2H \| 15 14 ddd 2H J 60 87 136 \| 14 13 m 2H \| 12 11 ddddd 1H J 15 34 44 59 68 \| 9 8 d 9H J 15	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CSc1nc(-c2ccc(C(F)(F)F)cc2)c2cc(C)sc2n1	ir: 2 2 2 1 1 2 2 2 1 2 2 1 3 9 2 1 1 2 4 3 1 2 1 7 1 1 1 1 2 2 3 2 2 2 1 2 1 2 1 1 1 1 1 2 2 1 2 6 30 33 8 70 100 10 16 12 61 29 3 1 3 3 2 0 1 4 9 1 2 3 2 1 1 2 1 1 1 1 1 3 2 1 1 1 1 4 4 1 1 1 2 1 2 6 8 3 1 7 7 15 13 2 2 2 1 9 3 2 1 3 5 16 36 7 2 7 10 6 2 8 4 3 3 2 2 16 1 5 2 1 1 2 1 1 1 1 1 2 2 4 36 73 12 5 9 42 18 7 3 5 6 9 3 1 1 2 2 4 2 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 2 1 1 2 1 1 1 3 1 1 3 4 3 4 16 4 12 50 14 7 4 4 3 3 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 78 77 dq 2H J 14 114 \| 72 71 s 1H \| 26 26 s 3H \| 25 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(C)C(=O)CC[C@@]2(C)C1[C@@H](CO)[C@@H](O)[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]12	ir: 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 1 1 1 0 0 2 1 1 0 2 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 1 0 1 1 0 1 1 0 1 1 1 1 1 1 1 2 1 1 1 0 1 2 1 2 3 3 5 3 4 5 9 24 31 17 10 9 4 4 1 1 1 1 1 1 1 0 1 1 2 3 1 1 1 1 1 1 2 1 3 3 4 1 2 1 2 1 2 3 2 1 2 0 1 1 0 1 2 0 1 1 1 1 1 1 0 0 1 1 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 1 1 1 1 1 1 2 1 2 1 1 3 2 2 2 3 2 4 11 3 2 3 2 3 2 0 6 8 54 100 29 6 5 2 1 1 1 2 1 1 1 1 1 2 1 1 1 1 1 1 0 1 1 1 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 40 38 m 2H \| 38 37 m 2H \| 37 36 tdd 1H J 20 39 55 \| 35 34 d 1H J 46 \| 27 27 d 1H J 53 \| 26 25 ddd 1H J 53 80 150 \| 25 24 ddd 1H J 54 81 150 \| 22 21 dqd 1H J 26 51 117 \| 20 19 m 2H \| 19 18 ddd 1H J 53 81 133 \| 17 14 m 10H \| 14 13 ddq 1H J 15 43 75 \| 13 12 ddtd 1H J 25 36 62 75 \| 12 12 d 3H J 14 \| 12 11 d 3H J 14 \| 9 9 d 3H J 14 \| 8 8 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(CC=O)(C(=O)c1ccccc1)c1ccccc1	ir: 3 2 0 1 2 1 0 1 2 1 3 2 3 1 0 2 3 7 10 2 2 1 1 2 1 1 1 4 3 2 4 5 31 16 13 36 100 6 4 3 2 63 14 7 3 2 2 6 2 1 18 4 2 1 3 12 5 1 2 2 1 2 3 5 2 0 1 3 19 8 9 3 2 1 2 4 2 3 3 7 1 1 2 2 1 1 2 6 1 1 4 4 1 1 2 1 1 2 4 4 0 1 2 3 2 10 1 1 1 2 3 7 9 12 10 12 11 6 6 15 7 6 3 10 1 4 2 4 3 4 5 2 4 6 12 13 7 2 2 2 3 10 38 36 34 14 13 7 5 39 36 2 5 8 3 1 1 2 1 0 4 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 3 2 2 1 3 5 3 2 1 2 3 2 5 33 17 21 27 38 33 16 13 3 3 2 3 2 2 1 2 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 97 96 t 1H J 57 \| 79 78 m 2H \| 76 75 tt 1H J 16 77 \| 74 73 d 4H J 40 \| 73 72 m 3H \| 33 33 dd 1H J 57 170 \| 31 30 dd 1H J 57 170 \| 16 16 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1cc(OS(=O)(=O)C(F)(F)F)ccn1Cc1cccc(F)c1	ir: 11 7 11 8 20 12 8 9 13 11 11 11 4 4 3 4 7 1 1 2 5 2 2 4 4 8 6 4 2 3 6 19 2 1 2 10 2 4 1 5 11 5 8 30 4 5 9 58 5 22 19 13 17 17 5 4 2 2 4 1 2 3 3 3 24 6 11 19 41 26 100 59 7 1 2 2 1 1 2 6 2 7 10 7 7 67 31 9 9 18 3 2 1 1 2 2 2 16 7 3 2 2 8 9 3 1 1 2 3 2 2 1 0 1 1 1 2 2 5 5 2 5 3 4 8 7 5 2 1 1 2 1 2 3 1 1 1 2 2 9 32 7 7 2 2 3 3 3 18 15 7 13 3 4 34 35 9 4 1 1 4 3 11 40 6 2 1 0 1 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 5 2 0 1 2 1 0 2 6 3 4 11 79 27 81 38 15 5 4 3 2 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 76 76 dt 1H J 9 79 \| 74 73 td 1H J 51 79 \| 72 72 ddq 1H J 10 21 77 \| 71 70 m 2H \| 66 66 dd 1H J 13 79 \| 63 63 d 1H J 13 \| 50 50 q 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Oc1nc2ccccc2nc1C(F)(F)F	ir: 9 5 8 19 9 3 2 3 2 14 13 29 22 10 3 2 4 3 15 30 39 35 14 7 3 2 2 1 2 2 1 1 1 10 7 2 2 2 1 2 2 0 4 25 44 10 4 1 2 4 3 1 2 10 19 1 3 2 4 2 2 2 1 3 2 1 7 12 7 9 35 15 2 2 22 12 12 20 19 5 2 3 3 17 9 3 1 1 2 2 1 1 2 100 90 4 4 6 16 4 13 2 1 1 2 4 9 10 2 4 1 1 2 1 1 1 1 1 0 1 10 9 1 1 1 1 1 1 1 1 0 1 1 1 1 9 15 1 1 1 1 1 1 12 4 6 6 30 2 1 2 4 29 3 1 0 5 1 1 1 1 1 1 4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 4 3 16 13 7 2 2 1 1 1 1 1 3 13 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 79 dd 1H J 14 82 \| 78 77 td 1H J 16 84 \| 77 77 dd 1H J 14 83 \| 77 76 td 1H J 13 84	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1ccc2c(n1)CCCC2=O	ir: 5 3 1 10 21 5 3 4 4 3 3 15 7 4 5 4 4 3 2 3 4 4 3 7 6 3 2 4 4 3 4 12 16 4 7 6 4 3 4 5 6 37 15 7 5 3 3 4 32 32 5 11 5 5 6 21 19 2 3 7 19 4 3 4 3 2 5 4 10 4 4 9 8 2 4 4 3 2 4 4 3 2 4 4 3 3 8 7 2 4 6 6 3 3 5 4 2 3 18 5 2 3 4 3 2 3 4 4 2 3 4 4 18 10 13 5 3 4 8 7 7 24 20 17 12 8 8 3 2 4 5 4 3 4 19 6 3 3 3 5 5 46 7 3 3 4 4 4 5 8 4 7 100 51 6 0 3 15 64 4 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 4 4 3 2 4 4 3 2 4 4 2 2 4 4 2 2 4 4 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 4 4 3 3 4 4 2 3 4 4 2 3 4 4 2 3 4 4 3 4 6 9 6 4 5 4 3 4 27 18 4 15 41 12 5 4 5 4 3 3 4 3 2 4 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 4 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2; 1HNMR: 81 80 d 1H J 82 \| 75 75 d 1H J 82 \| 30 29 m 2H \| 29 28 m 2H \| 21 21 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2c3c(c(=O)oc2c1)CN(CCN1CCOCC1)CC3	ir: 9 22 20 30 3 41 67 21 4 15 7 12 3 3 8 23 8 9 15 9 38 5 7 10 1 7 11 7 4 6 10 3 4 5 2 3 4 9 4 6 2 4 5 6 3 4 2 4 3 5 3 9 46 22 40 40 8 24 22 0 24 7 6 6 25 39 26 43 27 5 14 11 30 6 4 2 5 10 4 7 18 47 30 20 30 25 49 21 8 6 4 4 6 5 6 20 19 22 25 16 10 7 5 12 9 10 2 7 11 11 5 4 11 13 15 8 8 5 8 5 18 7 8 14 10 5 9 5 8 3 9 8 7 3 2 18 14 23 29 12 22 4 2 4 4 2 0 8 76 84 13 2 8 17 97 22 100 1 4 6 2 1 3 39 7 3 4 3 2 1 2 3 2 1 2 4 2 1 3 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 2 3 2 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 2 3 2 1 2 3 2 1 3 2 2 2 2 2 2 2 3 3 2 3 3 3 1 3 5 5 2 3 6 9 11 7 3 6 6 4 3 7 16 35 13 26 94 37 17 11 4 3 4 3 1 3 4 2 1 2 3 2 1 3 3 3 2 2 3 2 2 3 2 2 1 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 75 75 d 1H J 90 \| 69 68 d 1H J 24 \| 68 67 dd 1H J 25 91 \| 38 38 s 2H \| 37 37 m 4H \| 35 35 t 2H J 10 \| 31 30 ddt 2H J 10 44 52 \| 28 27 m 4H \| 26 25 m 5H \| 25 25 s 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1c2ccccc2nc(CCc2c[nH]c3ccccc23)n1-c1ccccc1	ir: 3 2 3 2 2 2 3 2 4 4 3 2 2 3 3 4 2 3 4 2 2 4 3 2 4 11 16 4 6 6 6 6 60 20 18 3 6 4 5 13 4 62 100 16 7 2 7 24 5 0 3 5 2 0 7 3 2 1 2 4 7 2 4 5 3 2 3 3 4 10 3 3 4 4 7 3 3 5 3 2 7 2 3 4 2 4 3 2 2 2 2 2 2 2 3 4 5 3 5 10 3 3 2 4 5 6 3 8 16 6 2 5 3 2 2 3 3 3 2 2 2 2 2 2 2 3 4 8 4 14 2 2 3 3 2 9 24 12 5 6 13 8 13 11 9 19 24 20 29 8 6 23 8 7 18 2 2 10 5 0 7 13 6 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 3 2 3 3 3 3 2 3 3 2 4 5 5 5 13 52 34 27 17 6 8 4 3 2 4 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 10 13 13 5 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 99 99 d 1H J 71 \| 83 83 dd 1H J 13 79 \| 78 77 ddd 1H J 14 70 85 \| 77 76 dd 1H J 13 85 \| 76 76 m 1H \| 75 75 m 2H \| 75 74 dq 2H J 15 76 \| 74 73 m 3H \| 72 71 td 1H J 11 75 \| 72 71 m 2H \| 30 30 td 2H J 8 71 \| 29 28 t 2H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NCC12CC3CC(CC(C3)C1)C2)c1cnn(-c2ncccn2)c1Cl	ir: 2 2 5 2 2 2 2 2 2 4 2 2 2 2 2 3 2 2 7 3 6 20 5 5 31 4 7 3 4 2 2 2 2 1 1 3 2 1 1 3 3 8 2 28 97 26 7 15 3 2 3 4 7 3 2 3 4 0 6 100 14 8 4 8 3 10 6 0 3 6 2 0 2 4 6 2 3 3 2 1 2 3 2 1 3 3 2 2 2 2 1 1 2 2 1 1 2 2 1 2 2 2 2 2 2 2 2 2 11 7 22 9 6 49 0 2 3 2 1 3 8 8 1 2 3 3 2 5 8 2 4 7 15 17 7 4 10 5 4 4 10 13 14 12 10 4 19 10 4 1 6 32 7 56 24 32 5 19 10 4 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 3 4 3 3 5 2 2 3 3 8 8 3 3 28 1 1 2 1 1 1 1 2 2 2 1 2 2 1 2 2 3 2 2 7 7 7 14 14 11 3 3 2 2 2 2 2 2 2 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 89 89 d 2H J 33 \| 82 81 t 1H J 61 \| 81 80 s 1H \| 78 77 t 1H J 33 \| 33 33 d 2H J 60 \| 21 20 ddd 3H J 51 58 109 \| 18 17 dt 3H J 57 130 \| 16 15 m 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1noc(C)c1-c1ccc([C@H](C)N2CC[C@](CC(C)(C)O)(c3ccccc3)OC2=O)cc1	ir: 8 11 11 11 6 7 12 6 4 10 8 4 3 12 9 4 3 11 10 43 18 5 6 4 3 7 10 4 3 12 10 11 7 7 11 6 12 59 70 16 25 9 34 3 3 6 4 4 4 5 4 1 7 23 30 9 13 7 4 2 18 18 15 6 13 8 5 10 47 14 4 2 7 6 8 5 10 25 48 18 15 14 18 18 17 14 7 5 12 9 10 18 16 8 8 8 18 22 3 4 9 11 16 18 19 13 3 4 9 11 6 7 15 13 9 11 12 8 23 12 13 18 10 10 8 11 74 13 31 14 20 16 9 8 45 28 16 30 19 11 9 8 7 17 29 14 13 14 6 5 75 44 43 13 6 5 4 1 2 4 3 0 2 10 3 0 2 5 3 0 3 5 3 0 3 5 2 0 3 4 2 0 3 4 2 1 3 4 2 1 3 4 1 1 3 4 2 1 4 4 1 1 4 4 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 0 2 5 3 0 2 5 3 0 2 5 3 0 3 4 2 0 3 4 2 1 3 4 2 1 3 4 1 1 3 4 2 1 3 4 1 1 4 4 1 2 4 4 1 2 5 3 1 4 8 9 3 7 9 7 8 7 12 10 10 10 20 17 26 40 15 53 76 67 21 9 2 7 8 15 100 29 12 7 2 4 4 4 3 4 6 3 3 4 6 3 2 5 4 2 2 4 3 3 5 4 4 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 2 1 2 4 2 1 2 4 2 1 2 4 2 1 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 1 3 3 1 1 3 3 1 2 3 3 1 2 3 3 1 2 3 3 1 2 4 3 1 2 4 2 1 2 4 2 1 2 4; 1HNMR: 75 74 m 2H \| 74 73 m 7H \| 71 70 tt 1H J 15 64 \| 49 48 m 1H \| 38 38 s 1H \| 36 35 ddd 1H J 37 64 125 \| 34 33 ddd 1H J 37 64 124 \| 26 25 s 2H \| 25 24 m 2H \| 24 24 s 3H \| 23 22 m 1H \| 22 21 t 1H J 149 \| 15 14 d 3H J 71 \| 14 13 s 2H \| 13 12 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN1CC2(CCN(C(C(N)=O)c3c(F)cc(Br)cc3F)CC2)OCC1=O	ir: 4 3 3 3 10 3 3 12 2 3 4 3 13 3 11 8 3 5 28 13 2 5 9 5 13 6 52 6 29 24 5 4 2 4 3 3 3 10 5 8 3 18 3 2 2 3 3 2 3 2 2 2 3 3 4 5 3 6 2 2 3 5 4 21 100 10 40 11 10 3 2 2 2 2 3 2 4 4 2 2 3 13 8 2 3 11 7 4 2 14 15 4 3 5 6 4 5 5 3 8 8 4 4 4 4 4 3 4 3 5 3 4 6 6 3 6 5 5 4 15 4 7 9 6 6 4 7 8 5 3 4 5 3 12 5 3 5 6 4 3 3 2 2 3 3 14 2 13 2 19 6 2 3 5 18 3 5 43 9 6 2 2 2 2 2 2 2 2 2 2 2 3 2 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 2 2 4 4 4 3 3 3 3 3 3 9 12 9 6 15 28 4 5 2 6 2 2 2 2 2 2 2 2 2 2 3 0 12 2 2 2 2 2 2 2 2 2 2 2 11 14 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 74 73 m 2H \| 66 65 s 2H \| 42 42 t 1H J 48 \| 41 41 s 2H \| 35 34 s 2H \| 34 33 q 2H J 72 \| 30 29 ddd 2H J 41 68 125 \| 28 27 ddd 2H J 41 68 125 \| 21 20 ddd 2H J 41 68 132 \| 18 17 ddd 2H J 40 68 132 \| 12 12 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1CCC2Oc3c(Cc4ccccc4)cc(-c4ccc(Cl)cc4Cl)cc3C2C1	ir: 3 2 3 2 3 16 15 10 5 7 17 37 12 3 5 3 2 8 16 4 5 5 2 1 2 1 2 1 2 3 8 11 2 4 2 1 6 5 10 5 23 11 3 2 1 3 2 1 1 1 1 3 10 3 78 9 3 2 2 3 1 2 4 5 3 2 15 28 19 24 4 13 3 2 2 1 2 2 4 3 1 1 15 4 3 4 12 3 5 12 2 2 2 2 9 15 5 6 8 4 7 2 2 3 2 10 5 5 8 4 3 5 13 9 7 7 10 12 40 35 26 8 6 5 6 6 8 4 13 7 11 11 6 4 4 13 16 7 16 23 8 4 6 44 10 3 9 10 16 1 9 41 5 3 3 1 1 2 2 1 1 1 3 1 1 1 0 0 0 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 1 1 1 1 1 2 2 1 2 2 7 5 2 2 3 5 7 7 5 32 9 37 100 24 24 9 4 2 4 2 2 1 1 1 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 76 76 m 1H \| 75 74 m 3H \| 73 73 dt 1H J 9 20 \| 73 72 m 2H \| 72 72 m 3H \| 45 45 dt 1H J 33 57 \| 42 42 dd 1H J 38 117 \| 40 39 m 3H \| 38 37 ddd 1H J 59 86 123 \| 36 35 m 1H \| 35 34 ddd 1H J 59 86 123 \| 24 23 dddd 1H J 33 59 90 132 \| 22 21 dddd 1H J 32 59 89 130 \| 15 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(C(CC2CCCC2)C(=O)OC)cc1	ir: 21 9 17 24 35 11 1 4 2 4 3 4 30 29 2 7 5 6 5 21 29 3 1 2 2 1 2 3 3 5 17 1 2 0 0 1 1 0 1 2 1 3 2 3 2 1 1 2 1 0 3 5 12 7 5 6 24 9 7 4 1 2 2 4 2 5 2 1 1 1 7 4 1 2 3 7 2 1 2 4 3 1 1 1 0 0 1 2 5 3 5 5 7 6 2 3 4 12 6 12 8 4 1 2 5 13 8 18 25 18 8 4 10 12 19 45 26 5 10 14 12 6 6 13 12 14 18 6 11 7 3 1 3 2 2 1 0 1 2 3 3 4 16 100 36 4 3 3 3 32 14 23 14 5 3 1 2 2 1 0 0 1 3 3 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 0 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 2 1 3 1 3 6 4 10 9 5 5 3 6 6 21 18 58 80 21 9 6 3 2 2 2 2 2 2 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 79 m 2H \| 73 73 m 2H \| 39 39 s 2H \| 37 37 s 2H \| 36 36 m 1H \| 21 20 ddd 1H J 67 81 141 \| 18 18 ddd 1H J 68 82 141 \| 17 15 m 4H \| 15 14 m 4H \| 14 13 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc2c3c(nn2c(C)c1Cl)CN(C(=O)c1ccccc1OCCN(C)CCO)C3	ir: 11 8 8 14 45 17 43 39 39 39 11 12 15 22 9 11 4 6 14 6 5 3 6 11 16 44 46 8 4 1 2 6 20 13 38 9 6 8 22 4 13 4 72 8 4 3 5 5 6 4 3 5 2 9 13 4 4 4 4 6 5 3 4 4 9 8 9 21 10 20 17 4 5 6 9 9 2 4 4 10 3 8 6 9 10 8 31 59 5 14 16 12 5 5 6 9 2 10 12 5 5 6 7 7 3 2 6 10 11 18 22 19 3 8 12 4 3 4 5 23 2 6 8 7 2 8 7 5 18 7 15 17 24 11 16 4 8 17 6 21 6 11 3 33 2 10 3 19 20 25 12 40 2 6 2 4 20 7 3 13 5 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 2 2 1 1 2 2 2 4 5 3 2 2 3 2 4 3 5 3 3 6 16 19 21 13 25 20 7 4 3 5 11 62 100 11 4 3 3 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 78 78 dd 1H J 16 81 \| 74 74 td 1H J 16 79 \| 71 71 m 1H \| 71 70 dd 1H J 12 81 \| 50 50 s 2H \| 49 48 s 2H \| 43 42 dt 3H J 61 231 \| 36 36 q 2H J 61 \| 29 28 t 2H J 62 \| 26 26 t 2H J 60 \| 26 26 s 3H \| 25 25 s 3H \| 24 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cn(Cc2ncccn2)nc1N1C(=O)c2ccccc2C1=O	ir: 1 1 1 2 1 2 2 1 1 1 1 1 0 1 2 1 4 3 12 8 14 4 1 2 5 13 8 3 4 2 2 1 1 3 19 10 1 2 4 43 59 32 1 4 4 2 3 4 15 3 1 5 4 5 4 7 8 4 2 9 8 1 1 5 5 2 2 4 1 1 1 3 1 0 1 1 2 4 5 1 1 1 1 1 1 0 1 2 1 3 4 1 1 1 1 1 1 1 3 2 1 0 1 1 1 2 9 3 1 1 1 1 3 6 2 1 1 1 3 3 2 3 3 9 6 5 1 2 1 1 2 2 81 6 4 2 1 2 11 6 3 5 8 19 5 3 27 3 1 14 2 1 5 73 100 39 21 0 7 11 3 1 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 0 1 1 1 0 1 1 1 2 1 1 1 1 2 2 2 3 4 15 35 19 2 7 7 2 1 1 1 1 1 2 1 1 0 1 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 87 86 d 2H J 42 \| 80 80 dd 2H J 31 51 \| 78 78 dd 2H J 31 51 \| 76 76 q 1H J 7 \| 72 71 t 1H J 42 \| 55 54 d 2H J 7 \| 23 22 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1c(-c2cccc(F)c2)c(C(N)=O)c2n1CCNC2	ir: 9 4 1 6 12 6 2 10 17 17 6 11 12 5 1 11 12 5 2 7 11 5 12 12 100 59 9 9 8 5 5 10 9 2 2 7 6 1 3 12 6 5 12 16 17 13 31 44 24 3 11 9 7 3 6 12 21 17 37 24 7 2 5 9 10 3 7 15 8 2 7 8 4 3 9 11 4 4 7 9 6 3 16 12 3 2 6 6 2 7 9 6 2 5 7 7 1 3 7 5 10 9 7 5 1 4 8 6 6 32 37 18 5 13 16 12 28 25 9 6 1 5 9 5 2 14 9 7 4 12 11 3 2 6 7 2 1 16 13 28 24 10 10 4 4 6 6 3 4 10 7 7 9 9 17 32 32 10 55 6 3 7 6 1 4 8 4 0 4 7 4 0 4 7 4 0 4 7 3 1 4 6 6 8 5 7 3 1 5 7 2 1 5 6 2 2 5 6 2 2 6 5 2 2 6 6 1 2 6 5 1 3 6 5 1 3 6 4 1 3 7 4 1 3 7 4 0 4 7 4 0 4 7 3 1 4 7 3 1 4 7 3 1 5 6 3 1 5 6 3 2 5 6 2 2 5 5 2 2 6 5 2 2 7 5 2 3 6 5 2 4 6 5 2 6 9 5 2 5 8 5 2 5 9 11 4 15 17 19 3 6 10 5 1 5 7 4 2 6 9 4 1 8 9 7 12 35 40 21 6 5 5 5 3 5 6 5 7 73 24 3 3 6 5 3 3 6 4 2 3 6 4 1 3 6 4 1 4 6 4 1 4 6 4 1 4 6 3 1 4 6 3 2 4 6 3 2 4 6 3 2 5 5 3 2 5 5 2 2 5 5 2 3 5 5 2 3 5 5 2 3 5 4 2 3 6 4 2 3 6 4 2 3 6 4 1 3 6 4 1; 1HNMR: 75 74 m 2H \| 73 72 dt 1H J 21 121 \| 71 70 m 1H \| 69 69 s 2H \| 41 41 m 4H \| 37 37 tt 1H J 27 35 \| 30 30 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCc1ccc(O)cc1	ir: 0 1 1 1 0 1 2 1 5 2 2 1 1 4 3 2 1 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 2 1 1 2 1 1 2 1 1 1 1 1 1 1 1 2 12 25 4 43 10 1 3 1 3 2 1 1 0 1 1 1 0 1 4 1 0 1 2 1 5 7 2 3 18 29 4 6 3 2 5 1 4 31 14 3 1 1 1 0 1 1 4 2 1 1 1 0 0 1 1 1 2 1 2 1 1 1 1 0 1 2 2 2 2 4 2 0 1 2 2 1 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 2 2 15 7 6 3 4 1 3 0 1 1 0 0 1 1 1 1 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 3 1 1 1 1 1 1 2 2 0 1 2 1 0 1 1 3 1 3 5 8 11 12 7 2 1 1 4 67 13 100 8 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 1 1 0 1 2 1 2 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 70 69 dt 2H J 9 86 \| 67 67 m 2H \| 65 65 s 1H \| 27 26 tt 2H J 9 64 \| 17 16 qt 2H J 64 76 \| 10 9 t 3H J 76	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OC(c1cccnc1)c1cncs1	ir: 8 5 20 17 10 2 1 2 3 6 9 2 3 1 1 2 3 2 2 2 3 2 1 4 3 8 2 2 4 4 9 5 7 53 51 11 2 1 1 1 7 6 1 3 2 1 2 1 4 3 8 4 11 2 3 4 6 2 1 3 2 1 13 8 6 3 10 7 5 7 10 14 2 0 2 3 2 13 17 14 35 100 97 13 43 26 6 3 3 5 9 6 2 3 1 1 1 14 3 2 7 11 19 2 2 1 1 1 2 1 1 4 15 37 23 2 1 1 4 2 2 6 3 5 10 11 4 1 1 2 1 0 0 1 3 17 11 3 2 7 2 3 1 1 0 2 1 1 1 1 1 2 7 4 4 0 1 2 5 5 3 1 1 2 1 1 0 0 1 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 2 2 3 1 1 2 2 3 3 2 5 7 25 19 14 1 0 1 2 3 34 15 2 1 0 1 1 0 0 0 0 0 1 0 0 0 1 1 0 1 2 1 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0; 1HNMR: 89 89 d 1H J 18 \| 85 85 td 1H J 8 20 \| 85 84 dt 1H J 17 48 \| 77 77 d 1H J 18 \| 77 76 ddd 1H J 15 23 78 \| 74 73 dd 1H J 47 78 \| 60 60 dd 1H J 8 57 \| 37 37 d 1H J 57	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)S(=O)(=O)C1Cc2cc(Cl)ccc2C1O	ir: 3 18 17 26 48 98 39 12 17 10 12 14 13 4 3 7 5 5 6 4 7 7 3 4 4 4 3 4 5 3 4 16 18 5 7 7 4 4 4 4 4 4 6 8 4 5 8 6 4 4 4 3 4 7 13 10 5 1 4 8 5 2 5 7 7 21 29 8 12 14 7 10 8 6 9 5 5 5 4 3 5 4 7 6 6 6 64 5 12 21 42 100 23 9 13 10 7 10 8 6 2 9 7 8 13 20 17 41 29 28 9 5 5 4 4 4 7 7 9 15 12 10 7 7 5 9 10 6 5 4 4 5 4 3 3 3 4 3 4 3 6 7 3 4 4 3 3 4 11 11 4 9 6 4 4 3 3 4 4 5 5 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 5 4 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 4 4 3 3 4 4 3 3 3 4 3 3 3 4 4 4 4 4 3 3 4 3 3 3 4 6 4 4 5 4 4 5 8 6 16 26 23 11 12 19 13 14 49 29 6 4 1 7 45 74 66 4 0 4 5 3 2 4 4 3 2 4 4 3 3 3 4 3 3 4 4 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3; 1HNMR: 73 73 m 1H \| 73 72 dd 1H J 24 81 \| 72 71 m 1H \| 55 54 m 1H \| 42 41 d 1H J 51 \| 38 38 m 1H \| 35 34 m 2H \| 33 32 ddd 1H J 9 75 150 \| 14 14 d 3H J 84 \| 13 13 d 3H J 84	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C(C)(C)Oc1ccc(S)cc1C	ir: 5 2 7 4 4 6 5 5 3 4 5 23 12 30 10 3 3 3 3 4 3 3 2 1 1 1 1 1 3 6 2 0 1 4 2 1 1 3 2 1 1 1 4 3 5 92 57 0 1 5 3 2 3 13 28 16 15 2 3 5 2 4 4 9 6 5 6 2 5 8 4 10 7 2 4 3 1 1 2 3 1 1 7 19 19 37 11 9 5 4 2 6 2 4 4 9 10 12 7 2 2 2 5 3 5 3 1 1 2 1 0 3 6 10 6 14 14 10 8 6 14 9 4 3 5 2 3 10 9 7 3 3 2 1 0 1 1 1 1 1 4 6 32 17 63 100 21 12 6 13 9 5 8 10 2 1 1 1 1 1 1 1 1 1 0 0 0 1 1 0 1 1 1 0 0 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 1 2 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 2 3 2 2 3 1 1 2 1 3 3 4 3 4 7 23 53 14 11 19 56 21 8 3 5 5 3 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 72 71 dd 1H J 22 70 \| 71 71 m 1H \| 69 68 d 1H J 69 \| 42 42 q 2H J 61 \| 36 35 s 1H \| 22 22 s 3H \| 15 15 s 5H \| 13 12 t 3H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1CN(S(=O)(=O)c2ccc(C(=O)Nc3ccc(Cl)c(-c4ccccn4)c3)cc2)CC(C)N1	ir: 17 8 3 3 7 6 3 5 3 2 3 2 2 1 5 6 1 9 7 11 2 1 1 2 2 2 5 5 5 5 3 8 11 4 3 5 3 13 6 24 28 26 8 2 6 4 6 2 2 2 2 2 6 23 8 20 27 12 5 18 8 6 5 21 18 1 1 0 2 6 10 2 7 35 7 2 1 1 3 17 3 2 10 15 27 6 19 28 8 9 2 2 0 0 1 1 5 2 1 7 9 1 21 2 4 2 4 4 4 11 8 5 4 1 1 1 1 6 2 12 6 2 3 5 6 5 5 2 20 12 8 7 2 3 3 7 2 1 1 1 3 5 4 10 14 5 1 3 9 4 4 5 1 4 9 5 3 18 1 0 0 0 2 10 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 1 1 1 0 1 1 2 2 2 8 3 7 43 11 5 1 1 2 1 1 1 1 1 1 0 1 3 3 3 3 5 31 100 8 5 3 17 5 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 86 86 dd 1H J 16 41 \| 82 81 m 2H \| 80 80 d 1H J 21 \| 79 79 m 2H \| 78 76 m 3H \| 75 75 d 1H J 81 \| 72 72 ddd 1H J 18 40 68 \| 38 37 dd 2H J 35 123 \| 35 35 dd 2H J 35 123 \| 30 29 dqt 2H J 34 51 70 \| 17 16 t 1H J 73 \| 10 10 d 6H J 52	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1oc(C(C)(C)C)cc1C(Oc1ccc(C(=O)O)cc1)C1CCCCC1	ir: 2 1 2 1 1 2 4 3 3 2 1 7 16 16 9 12 17 13 10 6 22 74 61 35 9 8 4 3 1 5 5 2 5 4 5 4 1 2 1 1 3 3 1 1 1 2 2 3 2 2 2 1 2 4 7 41 33 10 4 1 2 10 4 1 2 3 2 5 4 8 12 4 10 8 21 23 12 11 93 100 22 11 3 2 3 1 5 6 8 7 3 2 1 1 3 5 1 2 1 3 1 2 1 2 2 3 4 3 5 3 5 8 7 10 11 6 4 4 2 7 7 6 10 3 0 16 6 3 3 3 2 5 12 8 2 3 1 2 2 1 0 7 35 32 9 1 1 6 10 18 15 14 19 7 4 4 9 1 1 1 1 1 3 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 2 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 3 2 2 4 4 2 5 3 2 3 4 4 12 22 11 20 59 37 17 7 5 3 3 2 3 15 82 11 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1; 1HNMR: 80 80 m 2H \| 70 70 m 2H \| 63 62 s 1H \| 49 48 m 1H \| 23 23 s 2H \| 22 21 dp 1H J 62 73 \| 18 17 ddt 2H J 61 84 130 \| 16 15 m 2H \| 15 14 m 7H \| 14 13 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1cc(C(C)C)n(C2CCC(=O)CC2)n1	ir: 5 6 6 8 3 8 30 22 13 8 9 16 22 15 7 10 10 11 23 14 27 14 10 33 17 8 9 7 5 6 7 4 5 5 6 5 5 7 11 6 6 6 5 4 6 15 24 9 8 19 7 17 24 10 11 11 12 30 13 18 10 9 8 12 10 9 14 4 13 9 23 53 32 11 16 22 15 22 13 9 10 7 7 5 8 7 4 14 6 7 6 37 6 5 6 8 7 16 28 16 7 7 7 10 11 20 20 25 18 36 7 16 12 12 13 13 34 18 56 25 32 20 77 25 56 31 23 15 17 56 44 13 19 36 17 14 7 7 7 16 9 100 48 45 80 59 9 11 7 7 13 7 6 6 5 7 16 18 6 7 5 4 5 6 5 4 4 6 5 3 5 6 5 4 5 6 5 4 5 5 5 4 5 5 4 4 5 5 4 4 5 5 5 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 5 5 5 4 5 5 5 4 4 6 5 4 5 5 5 5 5 5 5 4 5 5 5 4 5 5 5 5 5 4 4 5 5 5 5 6 6 6 5 6 5 6 6 5 5 7 6 8 5 13 10 8 5 27 16 23 15 15 32 21 17 35 59 90 33 25 23 63 100 27 0 6 8 4 3 6 7 5 4 6 6 4 3 5 6 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 4 3 4 5 5 3 4 5 4 3 4 5 4 3 4 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 4 4 4 5; 1HNMR: 60 60 t 1H J 9 \| 46 45 p 1H J 37 \| 32 31 heptd 1H J 10 68 \| 31 30 heptd 1H J 9 60 \| 28 27 ddd 2H J 53 81 143 \| 26 25 ddd 2H J 53 81 143 \| 23 22 dddd 2H J 37 53 80 141 \| 21 20 dddd 2H J 38 53 79 141 \| 14 13 dd 12H J 64 111	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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