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DeerEyeRain
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sel_dataset

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train · 715k rows

Output stringlengths 5 127	Input stringlengths 850 1.64k	Instruction stringclasses 1 value
CCn1c(=O)c2c(C)n(C3CCCCO3)nc2c2cc(C#CCO)ccc21	ir: 3 3 4 4 2 3 3 4 3 5 5 5 3 3 3 3 2 3 3 3 3 2 2 3 2 3 3 3 3 2 2 2 3 2 3 2 2 2 3 2 3 4 3 5 4 2 2 2 5 9 9 5 4 4 7 32 8 5 5 5 4 7 3 2 3 4 6 6 15 7 5 5 3 3 3 3 5 8 8 12 9 3 14 13 14 17 14 15 13 5 5 3 3 3 2 4 3 3 2 2 3 2 2 2 3 3 4 4 6 6 4 12 9 4 3 6 4 7 5 8 4 5 6 6 4 4 6 4 3 3 3 2 3 3 4 4 3 3 2 2 2 4 3 2 2 2 2 3 3 3 7 4 3 0 100 16 3 5 29 1 2 2 2 4 40 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 2 2 2 2 2 2 2 2 2 2 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 3 3 3 4 4 5 4 7 5 5 4 5 8 8 5 8 22 7 6 6 4 2 6 7 32 22 8 8 3 3 3 3 3 2 2 2 3 2 3 3 3 2 3 3 3 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; 1HNMR: 82 81 d 1H J 21 \| 78 77 dd 1H J 22 75 \| 77 76 d 1H J 74 \| 59 59 t 1H J 23 \| 45 45 d 2H J 60 \| 43 43 q 2H J 76 \| 39 38 ddd 1H J 33 49 104 \| 38 37 ddd 1H J 32 49 104 \| 26 26 t 1H J 61 \| 26 26 s 3H \| 24 23 dddd 1H J 22 54 79 145 \| 21 20 dddd 1H J 22 53 78 145 \| 20 19 dddt 1H J 53 64 82 105 \| 18 17 m 1H \| 17 16 m 2H \| 13 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)c1cn(C[C@H]2CCCO2)/c(=N/C(=O)c2cc(C(F)(F)F)ccc2O[C@@H]2CCNC2)s1	ir: 3 7 7 4 5 4 5 3 6 3 5 7 6 38 6 11 3 6 9 18 2 5 6 4 9 10 14 5 11 9 11 10 5 4 6 6 5 4 5 4 7 13 6 19 18 8 16 14 7 5 8 6 7 11 30 56 6 8 6 23 34 6 16 18 13 8 36 50 28 20 24 23 13 6 11 11 11 6 10 12 4 3 2 1 1 2 1 1 3 5 6 8 6 5 4 3 2 7 14 22 17 18 16 14 22 35 12 46 69 51 63 43 43 19 26 14 12 17 26 32 26 27 19 9 21 10 5 7 7 6 5 5 4 2 4 16 9 10 3 4 9 15 20 100 15 3 15 36 32 23 17 16 9 3 2 7 3 1 1 1 1 2 3 3 1 1 1 1 1 0 1 1 1 1 1 2 1 1 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 1 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 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 2 1 2 1 3 3 3 3 3 3 2 6 5 5 10 6 20 3 14 31 28 15 34 12 4 4 1 2 1 1 0 1 1 1 2 2 2 6 42 74 7 2 4 2 1 1 1 1 1 1 1 1 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 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 dt 1H J 12 25 \| 79 78 m 1H \| 73 73 d 1H J 77 \| 70 70 t 1H J 9 \| 48 48 dddd 1H J 7 17 34 53 \| 42 41 m 2H \| 39 38 m 1H \| 38 38 dddd 1H J 17 30 49 101 \| 37 36 m 1H \| 33 32 ddd 1H J 8 34 125 \| 31 30 dddd 2H J 26 44 118 128 \| 30 29 m 1H \| 24 23 tt 1H J 28 38 \| 23 22 m 1H \| 21 19 dttd 3H J 19 31 67 164 \| 19 18 m 1H \| 18 17 m 1H \| 12 12 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1ccc(-c2ccc(O[C@@H]3CCOC3)cc2)cc1	ir: 2 5 3 5 5 2 2 3 2 5 2 2 3 3 4 3 7 7 4 7 9 31 100 6 5 3 2 3 3 2 2 2 2 2 2 4 2 1 2 1 2 3 2 1 2 2 2 3 2 2 3 4 5 3 27 3 5 10 2 3 1 1 2 2 2 2 2 3 0 19 2 1 4 5 3 12 14 7 7 9 7 2 2 1 2 2 3 4 5 2 2 2 2 2 1 1 2 3 1 1 2 1 2 2 2 2 2 2 4 4 2 2 2 2 6 13 5 3 3 3 3 3 4 5 8 3 3 3 2 1 1 1 2 1 1 2 2 1 1 2 3 4 42 10 5 26 7 2 4 3 3 13 6 4 2 1 2 1 1 1 2 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 3 2 2 2 3 2 3 7 3 10 41 7 6 4 3 2 2 2 2 15 15 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: 81 81 m 2H \| 77 76 m 2H \| 75 75 m 2H \| 70 69 m 2H \| 52 51 dtt 1H J 15 33 51 \| 41 40 m 1H \| 39 38 m 2H \| 38 38 ddd 1H J 30 48 110 \| 24 23 ddt 1H J 34 49 139 \| 22 21 dtd 1H J 29 50 139	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(c1ccc(Cl)c(Br)c1)C1(C(=O)OC(C)(C)C)CC1	ir: 2 3 1 3 6 1 3 5 4 3 2 2 8 2 6 8 2 1 4 10 2 1 0 1 0 1 0 1 1 1 5 1 1 2 3 3 3 7 2 1 5 2 3 3 1 1 2 7 5 2 1 2 5 5 19 10 2 0 3 3 2 16 4 2 1 2 11 12 4 2 1 1 1 1 1 3 1 1 3 10 3 3 3 1 1 6 1 1 1 7 6 6 3 5 6 4 16 6 2 2 1 1 4 9 8 4 4 6 8 2 2 1 1 1 1 2 4 3 3 5 3 3 5 13 4 4 8 20 15 21 16 11 11 3 2 1 1 14 0 1 1 1 2 7 7 90 14 14 12 2 2 2 4 2 2 1 1 1 1 0 2 5 1 1 1 0 0 1 0 1 0 0 0 0 0 1 0 1 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 0 0 0 0 0 0 0 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 1 0 1 1 1 0 1 1 1 1 1 1 2 4 2 2 1 1 1 1 1 1 2 3 5 7 4 26 8 7 100 5 2 17 9 4 2 1 1 1 1 1 1 1 1 1 1 1 1 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 0 0 0 0 0 0 0; 1HNMR: 75 74 dd 1H J 7 22 \| 74 74 d 1H J 76 \| 72 71 m 1H \| 48 48 tp 1H J 7 14 \| 33 33 d 3H J 14 \| 18 18 m 2H \| 15 14 s 8H \| 14 13 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(NC(c2ccc(Br)cc2C)C(C)C)cc1	ir: 11 5 2 5 5 9 24 13 69 37 87 16 6 12 10 9 6 3 6 8 4 5 8 3 11 8 3 4 6 7 8 4 3 8 5 4 3 2 3 1 1 2 1 1 1 2 2 1 2 2 3 13 12 7 37 54 26 13 5 1 4 3 2 2 9 3 5 4 4 6 12 5 4 4 4 6 3 4 2 8 2 2 2 2 2 2 4 3 6 3 5 2 2 2 4 7 8 2 5 5 2 7 2 16 26 21 7 6 6 3 1 3 3 4 4 61 20 9 4 11 6 11 7 16 21 13 12 8 5 3 5 9 4 3 4 7 13 4 9 24 64 17 11 20 43 13 5 4 4 9 14 45 45 21 17 9 2 1 1 2 4 1 2 19 7 2 2 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 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 0 0 1 1 0 1 2 2 1 1 2 1 0 1 2 1 0 1 3 2 1 2 2 1 1 2 3 2 2 5 5 5 2 8 23 39 73 43 22 11 9 3 4 3 3 2 1 2 3 1 2 2 4 5 2 2 3 5 21 15 100 70 22 16 5 4 2 2 3 3 2 3 4 3 2 2 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 1 1 1 1 1 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: 78 78 m 2H \| 73 73 dd 1H J 21 78 \| 73 73 d 1H J 18 \| 72 71 dd 1H J 7 79 \| 67 67 m 2H \| 49 49 d 1H J 86 \| 45 44 ddddd 1H J 7 15 30 62 68 \| 39 39 s 2H \| 23 23 s 3H \| 21 20 dq 1H J 63 127 \| 10 9 dd 3H J 15 64 \| 9 9 dd 3H J 15 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)N(Cc1cccc(-c2nc(NCCc3ccccc3)ncc2F)c1)C1CCNCC1	ir: 1 3 5 4 7 7 6 5 0 6 6 6 7 5 3 7 3 2 4 2 3 8 6 5 3 6 3 5 3 4 7 3 2 3 4 6 9 4 11 34 24 9 4 1 1 4 5 11 3 8 5 8 16 12 24 4 3 2 4 2 3 2 2 1 5 2 2 8 5 22 7 5 3 3 5 2 3 3 3 2 2 3 3 8 3 2 2 4 84 13 8 15 9 5 10 4 4 4 9 3 4 3 5 11 9 8 1 2 3 3 11 10 15 11 3 6 9 9 9 7 9 4 6 5 4 5 4 3 6 6 8 5 3 4 6 13 7 6 13 24 18 7 10 15 9 19 3 8 35 97 4 13 4 3 5 7 4 10 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 1 2 2 1 2 2 2 1 2 4 2 5 7 10 15 66 14 9 3 2 2 2 2 1 1 1 2 1 1 1 2 2 4 3 6 30 7 3 3 4 12 100 12 12 9 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 1 1 1 1 1 1; 1HNMR: 82 81 d 1H J 141 \| 77 76 m 2H \| 75 74 m 1H \| 74 72 m 4H \| 73 73 s 2H \| 58 57 t 1H J 46 \| 43 43 t 2H J 8 \| 36 36 m 1H \| 36 35 m 2H \| 36 35 m 1H \| 30 29 dddd 2H J 27 42 55 134 \| 29 29 m 2H \| 28 27 m 5H \| 21 20 dddd 2H J 28 55 68 121 \| 18 17 dddd 2H J 27 55 68 121	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(C(=O)C23CC4CC(CC(C4)C2)C3)cc1	ir: 18 2 2 3 2 2 2 2 14 7 9 3 2 2 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 3 4 4 8 4 1 4 4 1 5 5 1 4 10 5 4 100 18 6 3 1 4 8 7 17 5 58 6 6 4 3 1 0 3 2 2 1 1 4 1 3 2 1 1 1 1 3 1 1 2 1 1 1 1 1 1 1 1 2 3 2 1 1 1 1 2 1 1 2 2 2 22 4 1 1 2 1 2 3 9 5 7 7 28 16 21 5 1 2 3 3 1 4 4 3 3 3 4 3 2 2 2 2 3 3 2 1 2 2 12 10 5 17 4 0 8 18 5 9 4 15 10 8 7 12 4 11 12 3 2 1 1 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 2 3 2 1 1 2 3 8 1 23 33 6 15 5 3 2 1 2 1 2 1 1 1 1 1 1 1 1 1 2 2 3 4 13 11 22 11 4 2 4 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; 1HNMR: 81 80 m 2H \| 79 79 d 1H J 24 \| 78 78 m 2H \| 76 75 d 1H J 83 \| 75 74 dd 1H J 24 82 \| 39 38 s 3H \| 21 20 dqd 3H J 49 58 107 \| 19 19 d 6H J 49 \| 19 18 dt 3H J 58 128 \| 17 16 dt 3H J 56 128	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1ccc(OC(F)(F)F)c(Cl)c1	ir: 4 6 2 3 2 1 1 2 3 2 2 2 3 2 1 2 3 2 2 2 2 1 1 2 4 1 1 2 2 1 2 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 3 3 11 17 3 1 2 2 1 1 1 1 2 1 1 2 1 2 1 1 2 1 1 1 2 1 1 1 8 6 1 2 2 1 1 2 2 1 3 3 2 1 1 4 4 1 1 8 12 9 16 2 8 3 2 2 2 2 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 2 1 2 2 1 1 1 1 2 1 1 2 2 1 2 6 4 7 12 6 3 1 1 2 13 12 2 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 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 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 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 3 5 7 10 7 3 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 15 2 1 1 1 1 1 1 1 1 7 100 97 4 1 1 2 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 4 3 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; 1HNMR: 71 71 d 1H J 83 \| 68 68 d 1H J 21 \| 67 66 dd 1H J 22 82 \| 36 36 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCC1CC2CCC(C1)N2C[C@@H](C)CN1C(=O)COc2ccc(C)cc21	ir: 1 1 1 1 0 1 2 1 0 0 0 1 1 1 1 0 1 1 0 0 8 1 3 1 1 0 0 0 0 0 0 2 0 2 0 1 1 1 1 0 3 1 1 0 0 0 0 3 1 1 0 1 2 4 2 1 1 1 0 0 0 2 1 0 3 1 5 3 1 1 1 2 1 2 2 1 0 0 0 1 7 2 2 0 0 0 0 2 0 1 5 1 2 1 2 1 0 1 0 0 0 0 1 1 1 2 8 3 2 3 6 2 1 1 0 0 0 0 3 2 1 1 1 1 2 2 1 3 1 0 2 0 0 1 1 0 1 1 1 0 0 0 0 0 0 1 2 0 100 2 1 1 0 1 2 2 1 0 0 0 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 2 1 1 2 1 1 1 2 1 3 4 2 3 5 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; 1HNMR: 71 71 d 1H J 29 \| 71 70 dd 1H J 29 88 \| 67 67 d 1H J 88 \| 47 47 s 2H \| 42 41 dd 1H J 56 116 \| 40 39 dd 1H J 57 115 \| 32 31 tt 2H J 42 53 \| 28 27 dd 1H J 60 112 \| 25 25 dd 1H J 61 113 \| 24 23 d 3H J 8 \| 22 21 ddtd 1H J 17 59 75 132 \| 20 19 m 2H \| 18 17 ddd 2H J 55 70 124 \| 17 16 m 3H \| 16 15 ddd 2H J 55 70 124 \| 13 12 m 8H \| 10 10 d 3H J 75 \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CC(=O)N[C@H]1CC[C@H](c2ccc(C(N)=O)c3[nH]ccc23)C1	ir: 3 4 6 3 2 4 3 4 5 3 10 9 1 3 12 20 20 11 14 16 53 22 23 12 20 63 19 27 15 8 6 3 2 31 43 51 24 11 7 9 3 0 5 14 33 23 37 83 19 10 4 2 5 3 3 2 2 1 1 1 2 1 2 0 1 2 1 2 2 1 2 13 7 3 5 4 4 3 3 6 16 3 1 1 1 3 5 7 4 8 4 11 9 4 3 2 2 3 4 2 3 4 5 5 8 5 11 9 17 13 6 2 2 5 3 3 3 6 10 5 2 3 7 3 7 6 7 4 2 4 10 4 1 5 7 4 1 2 6 5 2 16 38 38 20 57 68 100 23 7 8 9 6 3 7 9 25 47 33 46 9 14 8 7 4 4 2 1 1 1 0 1 1 0 0 1 0 0 1 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 0 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 1 1 0 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 1 0 1 1 1 1 1 2 3 3 3 3 10 8 2 10 17 5 19 26 11 11 14 31 19 10 5 1 2 2 1 2 1 1 1 3 4 15 2 2 5 9 16 33 17 58 50 8 10 44 71 15 4 2 1 1 2 1 0 1 1 1 0 1 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 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 0 1; 1HNMR: 78 77 d 1H J 88 \| 73 72 dt 1H J 6 88 \| 72 71 dd 1H J 37 68 \| 71 71 s 2H \| 65 65 d 1H J 37 \| 65 64 d 1H J 66 \| 62 62 dd 1H J 106 161 \| 60 59 dd 1H J 31 161 \| 58 58 dd 1H J 31 106 \| 41 41 m 1H \| 30 29 m 1H \| 22 21 m 1H \| 20 19 m 3H \| 18 17 m 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)N1CCN(C(=O)C2CCNCC2)CC1	ir: 7 6 6 7 10 12 4 5 7 10 11 14 15 16 3 4 7 3 4 4 4 2 2 4 4 3 3 6 5 2 6 32 22 7 4 5 5 12 7 8 5 3 3 6 6 4 3 6 7 6 14 12 11 10 13 16 6 2 4 7 6 2 4 5 5 0 4 4 6 1 4 4 3 2 3 4 1 1 3 4 1 1 3 3 1 1 3 3 5 5 5 4 2 3 5 4 1 5 5 4 3 6 5 6 4 4 4 6 5 11 58 35 17 24 17 14 21 12 13 39 11 10 8 7 4 8 8 15 23 32 24 11 4 7 7 6 10 13 6 9 7 6 8 4 3 5 12 25 11 6 6 31 7 4 4 1 2 3 3 1 2 4 2 1 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 3 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 2 1 2 3 3 1 2 3 2 1 2 3 2 1 2 4 2 0 2 4 2 0 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 3 3 1 2 4 3 1 3 6 6 5 3 8 7 4 4 5 4 3 8 38 37 4 4 5 3 2 3 4 3 1 2 3 2 2 3 5 3 4 5 10 4 21 31 100 15 8 5 5 2 2 3 3 1 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 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 2 3 2 1; 1HNMR: 37 36 m 4H \| 35 34 m 4H \| 32 32 p 1H J 40 \| 30 30 dddd 2H J 30 40 58 137 \| 29 28 dddd 2H J 31 40 57 137 \| 26 25 p 1H J 66 \| 21 20 dddd 2H J 29 57 66 134 \| 18 17 dddd 2H J 29 57 66 134 \| 15 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1ccc2c(Cc3cc(OC)c(OCC)c(OC)c3)cncc2c1OS(=O)(=O)C(F)(F)F	ir: 6 3 3 3 9 5 5 6 3 42 25 10 9 3 2 2 2 2 7 9 8 9 20 7 7 2 2 2 3 1 1 1 3 1 4 2 3 3 2 2 1 1 1 2 2 3 9 6 12 6 4 3 3 0 5 6 11 12 8 16 10 3 2 4 4 3 5 22 12 3 16 30 13 9 13 4 11 7 8 4 6 5 5 4 3 17 100 5 4 7 19 8 2 3 2 3 1 13 5 2 2 1 1 2 2 6 4 3 1 2 12 5 3 12 9 5 4 5 3 2 1 2 2 2 3 3 2 4 2 3 2 2 3 2 2 1 1 1 3 3 2 1 1 5 1 1 1 1 2 2 1 2 2 6 2 3 7 10 1 3 3 2 2 2 1 1 3 2 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 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 1 2 1 1 1 1 1 1 2 1 2 2 3 2 2 3 8 10 7 10 37 26 11 7 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 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 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: 92 91 d 1H J 17 \| 83 83 q 1H J 10 \| 76 75 d 1H J 87 \| 70 70 d 1H J 88 \| 65 65 d 2H J 9 \| 42 41 qd 5H J 25 62 \| 41 40 q 2H J 9 \| 39 38 s 5H \| 15 14 q 6H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCn1nc(-c2ccccc2)cc1O	ir: 3 2 2 2 1 1 2 5 2 1 1 1 1 2 2 2 30 3 3 2 2 2 1 1 1 2 2 2 3 6 6 2 3 2 2 2 2 2 4 4 4 51 2 3 1 1 2 1 1 1 5 1 1 1 1 1 1 1 1 2 1 1 1 4 1 2 2 24 5 30 9 10 17 16 5 2 2 3 2 3 5 5 1 10 100 3 5 3 0 0 2 2 0 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 2 2 2 2 1 1 4 4 2 3 2 2 2 2 3 1 1 1 2 2 1 2 2 3 1 2 2 1 25 4 2 4 5 39 3 2 3 14 4 2 3 2 2 1 1 6 2 0 15 1 1 2 1 1 2 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 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 2 3 1 1 2 2 2 1 1 2 2 2 2 4 8 9 6 21 15 26 15 10 4 1 6 6 42 14 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 s 1H \| 79 78 m 2H \| 75 74 m 2H \| 74 74 ddt 1H J 13 66 80 \| 59 59 s 1H \| 39 39 q 2H J 49 \| 14 14 t 3H J 49	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)Cc1cc(OC)ccc1OC	ir: 16 8 17 6 9 4 11 4 3 3 4 3 0 3 7 2 3 5 3 3 9 4 6 3 5 4 3 3 1 3 4 4 2 4 3 2 3 7 4 3 2 2 2 1 2 3 1 0 2 4 5 3 6 100 28 10 5 5 4 4 4 4 12 10 24 8 10 24 16 5 7 3 3 2 4 2 3 2 1 1 1 1 1 1 1 6 5 3 4 6 6 6 4 3 2 3 4 5 6 4 1 3 10 5 5 3 2 2 4 1 2 2 2 2 3 4 10 5 3 13 9 15 8 9 5 4 5 5 8 5 7 8 7 4 3 2 2 3 2 3 5 13 26 47 47 43 14 6 6 8 21 12 4 7 6 7 3 1 1 2 1 1 3 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 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 1 2 2 1 2 3 2 3 5 3 2 2 2 7 4 11 9 14 19 48 19 14 4 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 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 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; 1HNMR: 69 68 m 4H \| 39 38 s 3H \| 38 38 s 3H \| 37 36 s 3H \| 36 35 d 2H J 8	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(NNC(C)=O)cc1	ir: 1 1 2 0 1 3 1 1 1 3 4 6 4 2 2 6 1 1 1 1 1 1 1 1 3 1 3 1 2 2 1 1 2 3 3 14 2 2 2 2 1 1 0 1 0 1 0 1 1 0 2 1 1 0 3 15 4 1 1 0 1 1 1 0 1 1 0 0 0 1 3 1 0 1 1 5 1 0 3 0 0 1 0 4 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 1 14 1 1 1 1 0 1 1 1 12 10 2 2 1 1 2 1 1 1 11 1 1 1 0 0 1 1 0 1 3 5 6 4 6 1 1 1 36 2 7 3 0 1 10 3 3 1 1 1 1 12 1 1 0 0 1 1 0 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 0 0 0 0 0 0 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 1 0 0 1 1 1 0 1 2 3 3 3 5 5 3 1 1 0 0 1 1 0 0 0 0 0 0 1 1 1 0 1 2 1 3 100 12 26 4 3 1 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; 1HNMR: 88 87 d 1H J 62 \| 79 78 m 2H \| 78 77 d 1H J 60 \| 72 72 m 2H \| 39 39 s 3H \| 21 20 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(S(=O)(=O)n2ccc(C(=O)c3ccc4ccccc4c3)c2)cc1	ir: 1 2 2 5 5 5 5 3 2 5 17 29 60 19 26 6 84 4 8 3 1 3 2 2 3 22 2 2 2 1 1 2 5 1 1 2 2 1 4 22 6 9 21 10 8 3 3 1 1 2 6 3 8 33 14 41 4 2 2 2 3 26 8 7 15 6 4 6 13 12 6 1 14 3 2 3 2 3 2 1 3 4 2 7 12 11 10 30 28 5 3 2 4 11 42 5 10 22 2 3 4 3 2 9 15 2 1 1 2 2 1 8 3 1 0 3 4 5 65 7 4 2 8 4 24 41 12 12 5 5 1 1 3 3 4 13 4 2 5 2 31 4 6 6 6 59 21 70 27 15 6 3 5 28 1 2 2 5 4 2 3 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 0 1 1 1 1 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 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 1 1 1 1 1 1 2 1 1 1 3 2 3 2 2 2 2 5 3 3 10 3 10 60 100 26 26 22 13 22 16 4 2 3 2 2 1 1 1 1 0 1 1 1 0 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 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 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 83 83 m 1H \| 80 79 m 3H \| 79 78 dd 1H J 16 83 \| 78 78 m 2H \| 77 76 ddd 1H J 14 69 80 \| 76 75 ddd 1H J 17 71 87 \| 72 72 ddt 2H J 9 14 80 \| 69 69 t 1H J 17 \| 69 68 dd 1H J 17 56 \| 66 66 dd 1H J 18 57 \| 24 24 d 3H J 10	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCNc1cc(C=O)cc(S(N)(=O)=O)c1Oc1ccccc1	ir: 2 3 8 35 8 3 5 3 4 4 8 13 11 5 12 5 9 3 2 5 15 40 56 12 2 7 12 7 4 5 3 5 1 2 1 1 1 2 2 2 27 18 2 2 2 5 2 3 2 2 2 1 2 4 2 1 3 4 3 27 13 2 3 2 3 9 4 39 11 8 7 6 4 7 4 6 1 6 5 2 4 3 12 8 13 14 15 23 71 17 37 24 30 12 23 15 12 4 3 15 8 5 1 4 3 5 3 1 37 9 4 2 12 12 5 17 12 8 41 81 14 10 7 5 3 4 8 5 4 4 3 6 6 36 6 40 12 12 12 52 23 8 6 11 7 10 3 3 28 7 3 24 5 5 4 2 1 0 6 7 2 0 1 5 3 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 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 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 2 1 1 1 1 2 2 3 4 3 5 7 5 4 4 4 13 16 45 32 9 8 4 7 10 8 4 3 4 2 2 4 2 2 2 4 21 12 30 10 16 40 25 100 62 11 3 5 8 3 1 1 1 1 1 1 1 1 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 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 0 1 1 0 0 1 1 0 0 1 1 0 0 1; 1HNMR: 100 99 s 1H \| 82 82 d 1H J 23 \| 75 74 d 1H J 23 \| 74 74 s 2H \| 74 73 m 2H \| 71 71 tt 1H J 14 75 \| 70 70 m 2H \| 69 69 t 1H J 54 \| 59 58 ddt 1H J 49 99 170 \| 53 53 m 1H \| 53 52 dq 1H J 11 170 \| 40 40 tt 2H J 14 51	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(Br)C(=O)NC12CC3CC(CC(C3)C1)C2	ir: 0 1 0 1 1 2 1 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 2 6 1 1 0 1 2 3 2 9 4 1 6 12 7 2 0 0 0 0 0 2 2 0 0 0 3 0 0 0 0 4 2 0 0 0 0 0 1 0 0 0 1 1 1 2 2 1 0 1 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 0 0 1 2 2 1 1 1 1 1 0 1 1 0 1 0 1 6 2 4 9 3 2 1 1 0 1 1 0 0 2 0 1 1 2 2 10 1 1 1 1 0 0 0 0 0 0 0 0 0 1 1 2 3 60 100 9 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 0 0 0 0 1 0 0 0 1 0 1 1 2 1 4 3 6 2 3 4 10 3 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 1 0 0 3 2 1 10 28 2 0 1 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 66 66 s 1H \| 44 43 q 1H J 63 \| 21 20 m 9H \| 18 17 d 2H J 64 \| 17 15 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)OC(=O)C(C)(C)C(O)(c1ccc(Br)cc1)C(F)(F)F	ir: 2 5 5 3 1 3 3 2 3 12 7 9 12 12 6 4 7 7 8 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 3 2 1 1 1 0 1 1 1 0 1 1 2 3 2 1 1 1 2 1 11 6 6 4 2 4 1 2 1 2 2 2 3 3 5 2 1 0 1 1 1 1 2 3 6 1 2 2 2 3 4 4 5 5 9 7 2 2 8 5 19 29 7 37 2 0 2 2 0 1 2 1 0 1 3 2 1 3 3 2 1 5 3 4 1 4 2 1 1 6 5 1 1 4 3 3 1 1 3 2 1 1 1 0 0 1 1 0 0 2 2 36 3 7 17 3 1 1 1 2 2 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 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 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 2 1 1 1 1 0 1 2 1 1 1 2 2 7 7 2 4 10 7 6 8 10 100 23 4 7 3 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 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 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: 75 75 m 2H \| 73 73 m 2H \| 50 50 dq 1H J 54 108 \| 42 42 q 1H J 33 \| 15 15 s 3H \| 14 14 s 3H \| 12 12 dd 6H J 29 55	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CC1(C(=O)OCC)Cn2c(cc3ccccc32)C1O	ir: 4 3 8 4 5 5 3 2 3 5 3 1 1 3 0 1 1 2 0 0 0 1 0 1 2 3 0 1 1 0 1 1 0 1 1 1 1 0 1 1 2 9 6 12 8 10 2 1 1 2 2 1 0 1 1 0 1 1 1 2 1 1 1 1 1 1 1 1 3 4 1 2 2 3 2 1 4 4 2 1 1 3 10 19 26 4 7 4 2 3 2 1 3 1 3 6 2 3 2 2 1 3 1 4 2 2 1 1 1 1 1 6 3 5 7 4 1 2 2 3 2 4 2 3 6 4 2 1 2 2 2 3 2 2 2 2 1 4 7 1 1 1 4 4 18 17 3 1 1 1 0 0 1 3 0 1 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 1 1 1 1 1 3 5 5 6 2 3 3 5 3 2 2 3 10 5 5 13 6 6 5 1 1 2 4 100 71 5 2 1 1 1 1 0 0 1 0 0 0 1 1 1 1 0 0 2 2 2 2 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 0 0 0 0 0 0 0 0 0 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: 77 76 ddt 1H J 9 16 66 \| 74 74 m 1H \| 73 72 td 1H J 13 66 \| 72 71 td 1H J 15 68 \| 68 67 m 1H \| 55 55 m 1H \| 45 44 d 1H J 145 \| 43 43 d 1H J 40 \| 42 41 m 5H \| 32 31 d 1H J 174 \| 30 29 d 1H J 174 \| 13 12 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCS(=O)(=O)N(C)C1CCCCc2ccc(F)cc21	ir: 18 4 0 4 7 16 15 35 8 4 2 2 5 10 2 2 3 3 2 2 4 1 1 2 4 1 1 2 2 1 2 2 2 1 2 23 7 2 2 8 5 5 3 4 5 16 6 5 3 0 5 18 21 5 8 10 3 1 2 5 6 2 1 3 4 3 2 28 5 30 21 46 22 16 6 6 18 3 6 3 3 8 6 5 8 12 32 10 100 43 14 7 6 7 14 10 19 13 8 4 3 5 5 4 2 3 15 22 23 20 7 6 5 4 7 4 3 16 32 17 8 10 8 5 6 5 4 2 5 6 3 2 1 2 2 2 2 6 4 3 1 2 2 7 22 4 3 1 1 11 5 2 3 6 2 1 1 2 1 0 1 6 3 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 1 2 2 1 1 1 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 0 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 0 1 1 1 1 2 1 1 1 2 2 1 1 3 2 3 2 3 2 6 6 9 5 6 6 6 6 7 7 14 21 13 5 37 33 6 4 4 2 1 2 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 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 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 2 1 0 1 2 1 0; 1HNMR: 71 70 ddt 1H J 9 47 81 \| 70 69 m 2H \| 41 40 m 1H \| 34 32 m 2H \| 29 29 d 3H J 16 \| 28 27 m 2H \| 21 20 dtd 1H J 78 85 119 \| 19 17 m 2H \| 17 15 m 3H \| 14 13 t 3H J 89	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(NC(=O)n2ccnc2)cc1C	ir: 8 3 20 5 6 4 3 7 6 5 7 5 3 4 6 5 4 4 5 5 3 6 4 2 3 3 3 2 2 2 2 1 2 3 3 3 3 2 4 7 12 17 8 2 3 3 11 8 18 23 7 5 7 7 14 14 8 2 3 3 3 2 2 3 3 4 3 2 4 9 9 32 16 1 8 14 5 3 4 17 5 2 5 8 2 18 13 15 6 23 14 21 35 15 6 10 11 6 7 4 4 2 2 2 3 12 1 3 17 15 20 5 4 2 2 2 5 8 9 10 8 4 5 8 8 4 9 6 3 3 3 9 17 12 8 5 11 13 7 24 27 21 17 7 4 3 2 2 2 2 3 11 14 31 4 10 8 4 2 1 1 2 1 0 1 67 1 4 1 0 1 2 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 10 3 2 2 2 1 2 2 3 2 3 3 8 31 34 22 23 100 53 63 15 13 3 2 1 0 2 2 1 1 2 2 1 1 2 3 3 2 4 5 9 15 7 3 3 1 2 2 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 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; 1HNMR: 83 83 t 1H J 17 \| 83 82 s 1H \| 79 78 d 1H J 84 \| 78 77 dd 1H J 16 42 \| 75 74 m 1H \| 74 73 dd 1H J 22 84 \| 72 72 dd 1H J 16 40 \| 39 39 s 3H \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1c(=O)[nH]c2nc(-c3nn(Cc4ccccc4F)c4ncccc34)nc(C#CC(C)(C)O)c21	ir: 1 0 1 1 1 1 2 2 2 1 0 0 0 0 1 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 1 0 0 1 1 1 8 8 11 4 2 4 2 2 1 3 4 1 0 0 0 0 0 0 0 1 1 1 1 0 1 0 1 1 0 0 0 1 0 0 0 0 0 0 1 0 0 1 3 3 1 1 1 1 0 0 1 0 1 1 1 0 0 0 0 0 0 0 0 0 1 1 2 2 0 0 0 0 0 1 1 0 0 1 1 2 0 1 1 1 1 2 1 0 0 1 2 1 1 1 1 11 1 0 0 0 4 1 0 1 1 1 2 5 1 0 1 0 1 1 1 0 2 1 8 1 0 1 5 100 5 0 0 0 0 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 0 0 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 6 3 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 1 1 11 5 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; 1HNMR: 86 85 dd 1H J 21 34 \| 84 83 dd 1H J 21 78 \| 75 74 dd 1H J 34 78 \| 74 73 m 2H \| 72 71 qd 3H J 14 88 \| 58 57 dd 2H J 8 39 \| 38 37 s 3H \| 24 24 s 1H \| 15 15 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)Cn1ncc2cc(Oc3ccc(F)cc3F)c(C#N)cc21	ir: 3 4 2 3 3 5 3 3 3 3 2 5 9 9 23 14 7 7 4 5 3 1 1 3 3 2 1 4 5 2 1 3 3 1 2 4 4 1 7 3 2 1 2 4 6 3 2 5 2 0 2 4 4 8 40 26 9 1 3 4 3 1 2 4 5 3 16 57 30 11 6 2 2 2 2 2 2 1 2 2 2 2 2 4 2 1 2 5 3 4 2 2 2 6 5 6 4 7 8 7 3 2 3 7 4 6 7 7 17 15 6 4 2 2 5 3 1 6 5 5 5 6 4 2 2 3 2 1 2 2 4 3 14 12 5 4 1 2 2 1 6 8 10 6 3 10 19 3 3 23 27 4 14 5 4 2 2 3 2 0 4 8 1 2 2 2 2 1 1 2 1 1 1 2 1 1 3 3 1 1 2 2 13 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 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 1 2 2 2 2 2 2 2 3 2 3 2 2 3 3 3 4 4 8 13 10 100 24 6 4 7 3 2 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 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 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 81 80 d 1H J 17 \| 79 79 s 1H \| 77 76 d 1H J 17 \| 71 71 ddd 1H J 42 57 81 \| 70 69 m 2H \| 41 41 d 2H J 46 \| 22 21 dtt 1H J 45 70 141 \| 10 10 d 6H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc(OC)c1C1CCCC(=O)N1Cc1ccnc(-n2cccn2)c1	ir: 2 3 0 6 6 8 17 14 34 18 15 13 7 6 4 5 5 10 6 3 7 7 5 4 2 5 2 23 18 12 9 6 8 12 8 21 11 13 11 7 30 14 6 8 8 7 17 8 57 6 9 6 4 9 3 8 7 0 4 4 4 1 3 10 19 8 18 61 42 14 17 10 17 23 16 4 9 10 6 14 4 6 4 5 3 5 6 2 4 7 11 19 9 14 7 5 2 3 3 5 3 21 7 4 4 4 4 9 5 3 3 6 13 7 4 3 1 3 9 19 19 14 12 28 28 19 8 19 16 5 4 2 6 8 27 24 8 4 9 13 28 15 73 16 12 6 8 17 44 70 16 9 18 6 9 4 6 10 13 3 3 5 54 9 3 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 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 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 2 1 1 3 3 3 4 4 5 4 5 4 4 3 5 17 19 12 12 100 60 24 36 29 6 3 2 5 4 2 3 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 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 1 1 1 1 1 1 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 37 \| 80 80 d 1H J 39 \| 79 78 dt 1H J 9 18 \| 77 76 d 1H J 19 \| 74 73 ddt 1H J 9 20 39 \| 72 71 t 1H J 84 \| 67 66 d 2H J 84 \| 66 66 dd 1H J 16 38 \| 50 49 dt 1H J 9 123 \| 49 48 t 1H J 61 \| 48 47 dt 1H J 9 124 \| 39 38 s 5H \| 26 24 m 2H \| 23 21 m 2H \| 20 19 ddt 1H J 59 90 119 \| 19 18 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#C/N=C1\CC2(CCOC2)Oc2ccc(Br)cc21	ir: 9 12 0 4 18 27 10 7 6 5 7 3 7 4 2 6 5 3 6 8 14 4 6 7 4 1 2 6 2 3 4 3 7 10 8 14 30 6 6 7 4 3 2 3 5 2 2 3 7 12 13 60 15 19 86 16 13 0 2 4 2 3 8 7 4 3 7 15 13 4 4 6 1 21 12 5 2 2 5 4 6 7 5 14 6 6 7 3 2 14 5 2 2 3 2 2 1 2 8 6 5 3 3 2 3 27 6 3 3 7 8 4 0 3 3 3 2 3 8 10 14 9 5 7 3 7 33 20 12 14 12 3 1 3 3 2 14 14 3 2 2 3 3 1 5 23 100 12 5 2 7 31 12 26 7 2 1 3 2 1 2 5 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 4 22 3 2 1 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 1 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 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 3 3 6 17 10 7 5 6 2 4 8 7 41 12 26 40 52 32 6 3 1 0 2 3 2 0 2 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 2 1 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 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 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 0; 1HNMR: 76 75 m 2H \| 71 70 m 1H \| 41 41 m 1H \| 39 38 m 2H \| 38 37 ddd 1H J 32 50 112 \| 30 29 d 1H J 161 \| 28 27 d 1H J 159 \| 24 23 m 1H \| 21 21 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CNCC(=O)CN(C)C(=O)OC(C)(C)C	ir: 7 5 15 16 16 17 10 12 14 12 24 34 18 4 8 2 2 1 2 2 1 2 1 3 3 3 10 8 11 7 3 2 5 3 2 6 7 13 25 35 21 19 11 15 11 8 6 7 10 6 6 28 44 25 16 16 24 29 23 22 16 15 12 9 8 10 5 3 2 3 2 2 4 5 3 3 2 3 2 1 1 1 1 1 1 1 1 1 1 1 3 8 7 4 3 2 4 5 4 6 3 3 10 6 5 1 3 3 0 4 9 12 36 44 56 100 96 33 12 21 25 24 8 12 29 16 15 13 19 25 21 17 19 15 12 7 8 4 3 7 7 6 11 10 23 7 3 3 4 9 6 49 3 1 1 2 1 0 1 2 1 0 1 2 1 0 1 1 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 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 1 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 2 1 3 2 2 2 4 13 4 4 6 3 4 2 4 8 5 18 56 9 11 5 4 2 2 1 2 2 3 2 2 2 1 1 2 3 2 3 5 10 29 58 50 38 7 3 4 2 2 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 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; 1HNMR: 42 41 q 2H J 66 \| 41 40 s 2H \| 36 36 d 2H J 65 \| 36 35 d 2H J 64 \| 31 30 p 1H J 65 \| 30 29 s 3H \| 15 14 s 8H \| 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.
COC(=O)c1ccc(Cc2ccccc2CBr)cc1	ir: 11 4 3 7 8 7 13 4 1 3 3 5 2 31 24 7 5 4 3 3 2 1 1 3 4 7 2 2 3 2 12 12 4 6 2 5 19 15 7 4 2 6 10 29 9 4 3 4 3 3 7 20 14 3 3 5 8 62 37 2 2 2 1 1 1 1 1 1 2 0 9 1 1 1 7 8 3 3 5 3 2 3 1 2 1 1 5 6 6 7 5 23 3 4 3 2 1 1 3 5 7 2 2 2 3 5 4 1 1 1 1 2 2 3 5 97 56 7 3 6 6 4 2 4 38 54 6 3 1 3 5 3 1 2 2 1 2 15 10 1 2 5 22 74 35 4 4 4 14 18 15 22 13 6 3 3 1 2 2 1 1 1 4 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 4 5 3 3 1 4 3 5 4 17 19 45 100 42 16 11 5 4 4 4 3 2 1 2 3 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 1 1; 1HNMR: 78 78 m 2H \| 73 71 m 7H \| 45 45 d 2H J 8 \| 41 41 q 2H J 9 \| 39 39 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(c1ccc(OC(F)(F)F)cc1)C1CCN(Cc2ccccc2)CC1	ir: 9 8 2 2 2 6 16 4 2 1 1 2 2 3 1 3 1 2 1 1 1 1 1 1 3 2 4 4 1 6 3 2 14 22 2 3 3 9 13 13 26 7 2 2 3 2 1 2 1 6 1 3 22 6 3 4 33 27 2 0 1 2 1 1 2 3 3 6 13 3 2 1 1 2 1 2 5 4 3 2 4 15 80 10 13 1 3 4 12 37 4 3 12 5 4 2 5 34 31 70 40 99 29 3 5 7 5 5 1 5 2 4 4 22 7 5 2 2 2 2 5 3 3 5 5 3 6 4 1 3 9 9 3 2 4 23 12 1 2 2 7 8 57 13 4 2 2 3 3 11 11 15 6 3 3 3 2 1 1 1 1 1 1 14 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 1 2 1 1 1 2 1 2 2 3 5 2 2 4 6 2 3 21 8 19 100 40 16 5 4 4 4 4 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 1 1 1 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 m 2H \| 73 72 m 5H \| 73 73 s 3H \| 35 35 d 2H J 7 \| 32 31 p 1H J 59 \| 29 29 ddd 2H J 54 81 123 \| 27 27 ddd 2H J 53 81 123 \| 22 21 ddt 2H J 56 81 124 \| 19 18 ddt 2H J 55 79 125	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1=C(C(=O)O)C(c2ccc(F)c(F)c2)NC(=O)N1	ir: 1 1 5 2 1 1 1 1 1 1 1 1 2 11 3 7 3 1 1 1 1 1 1 8 20 4 2 1 1 1 3 1 1 1 1 2 1 2 2 13 2 2 3 3 50 4 2 1 1 1 1 1 1 10 1 3 1 1 1 1 1 1 1 1 1 1 1 2 3 2 1 1 1 1 1 1 5 2 5 2 1 1 1 1 5 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 5 3 1 1 2 3 2 2 1 1 2 1 2 2 2 2 1 1 1 1 1 2 1 1 1 1 1 1 1 1 3 9 1 1 1 1 1 1 11 3 1 1 2 1 16 0 1 1 1 1 63 8 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 4 2 2 2 8 7 1 1 2 1 1 1 2 2 100 1 0 1 1 1 1 1 1 2 2 2 2 3 8 17 6 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; 1HNMR: 88 88 s 1H \| 74 73 m 1H \| 72 72 m 2H \| 69 69 d 1H J 73 \| 54 53 dt 1H J 11 71 \| 23 22 d 3H J 10	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Clc1cccc2c1COc1ccccc1C2=CBr	ir: 0 1 2 1 0 1 1 0 2 2 1 1 1 1 1 0 0 1 1 0 1 3 1 1 2 1 1 0 0 1 1 1 0 1 1 0 0 2 2 4 8 5 17 34 5 5 11 20 4 4 1 1 1 0 1 1 1 0 1 1 1 1 1 1 2 5 4 1 7 5 1 1 3 4 3 5 2 2 1 1 1 1 2 4 1 1 0 1 3 7 9 2 1 1 1 1 1 1 1 0 1 1 1 1 2 1 0 0 1 0 0 2 1 6 1 0 1 1 0 1 3 1 1 1 3 6 1 1 1 1 1 1 1 1 1 5 12 23 11 4 3 3 8 3 1 2 2 4 13 1 1 3 1 1 2 7 6 0 3 1 1 0 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 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 2 1 0 2 3 5 2 25 100 23 10 9 2 1 2 1 0 1 3 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 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 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 76 75 dd 1H J 19 75 \| 74 73 t 1H J 81 \| 73 72 m 3H \| 71 70 dd 1H J 17 76 \| 69 69 dd 1H J 15 80 \| 67 67 s 1H \| 51 51 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(OCC)c1ccn(C)c(=O)c1	ir: 30 69 6 2 2 1 1 2 7 4 1 1 2 1 3 2 2 1 1 2 4 1 1 2 12 7 13 2 2 1 1 1 2 1 1 2 2 1 14 48 7 2 3 2 2 1 2 3 2 1 3 73 9 4 3 0 3 4 5 8 2 3 3 14 2 8 8 69 31 6 6 14 19 6 17 12 17 38 9 2 3 2 2 5 4 2 2 1 2 1 4 6 4 21 15 4 4 3 2 1 2 1 3 4 4 13 4 2 2 2 2 4 7 14 9 8 8 14 11 7 14 4 3 4 4 10 15 8 20 9 2 4 11 4 2 1 1 2 3 2 3 50 8 1 2 4 14 49 7 7 3 3 3 6 12 45 8 2 2 2 1 2 19 8 1 0 1 2 1 0 1 2 1 0 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 1 1 1 1 1 2 1 1 1 4 7 2 2 2 2 3 3 4 4 4 2 4 4 17 24 9 4 5 31 100 22 27 7 1 3 2 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 dq 1H J 10 75 \| 68 67 dt 1H J 15 77 \| 65 65 t 1H J 11 \| 50 50 dd 1H J 9 18 \| 37 36 dq 2H J 66 115 \| 36 35 dq 2H J 66 115 \| 34 34 d 3H J 11 \| 12 12 t 6H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCC(C=O)(c1ccc(Cl)c(Cl)c1)N(C)C(=O)OC(C)(C)C	ir: 10 14 2 10 15 18 1 8 7 9 9 7 11 8 5 40 16 18 5 20 16 11 6 6 5 3 3 25 7 4 2 5 4 2 16 7 4 1 5 6 8 10 3 5 5 4 3 5 3 1 3 5 10 48 24 14 6 0 4 7 3 4 9 6 4 2 4 7 11 16 16 38 24 1 5 10 7 3 5 5 4 3 7 9 5 3 4 5 3 3 6 11 7 4 6 4 3 5 5 4 6 9 14 7 8 11 31 10 2 4 8 5 1 4 6 4 2 5 8 8 4 9 11 10 2 6 13 17 7 30 90 100 14 11 5 3 4 6 13 12 8 6 5 3 3 4 4 5 6 50 88 85 24 9 11 3 2 5 4 1 3 5 4 0 2 5 3 0 2 5 2 0 2 5 3 0 2 4 2 0 3 4 2 0 3 4 2 1 3 4 2 1 3 4 1 1 3 4 1 1 3 3 1 1 4 3 1 1 4 3 1 2 4 3 0 2 4 3 0 2 4 2 0 2 4 2 0 2 5 2 0 2 4 2 0 3 4 2 1 3 4 2 1 3 4 2 1 3 4 1 1 3 4 1 1 3 3 1 1 4 3 1 2 4 3 1 2 5 4 1 7 6 6 3 3 6 4 1 4 9 9 7 9 10 46 14 34 51 30 9 5 9 5 5 5 6 3 1 3 4 2 1 3 4 2 2 3 3 2 1 3 3 2 1 3 3 1 1 3 3 1 2 3 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 3 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 2 1 2 4 2 1 2 4 2 1; 1HNMR: 98 98 d 1H J 9 \| 75 74 d 1H J 22 \| 74 73 d 1H J 79 \| 73 73 dd 1H J 23 80 \| 59 58 ddt 1H J 68 106 161 \| 52 52 dq 1H J 14 161 \| 51 50 dq 1H J 12 106 \| 31 30 m 4H \| 29 28 ddq 1H J 13 68 147 \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(N[C@H]1CCOC[C@@H]1O)c1cn(Cc2ccc(F)cc2)c2c(Cl)ccnc12	ir: 3 5 6 3 2 6 5 8 4 10 17 8 4 9 11 3 3 16 9 7 8 11 7 17 4 8 17 15 11 20 8 15 15 7 6 2 3 7 6 1 3 12 10 32 88 48 38 10 22 11 4 5 12 19 13 31 27 8 5 1 3 5 4 2 3 6 5 10 17 19 3 3 4 10 11 2 30 6 3 2 6 19 2 2 4 5 13 3 4 7 2 5 19 22 21 28 27 27 27 7 11 24 6 8 6 16 9 10 17 10 4 21 5 5 2 3 6 4 1 3 7 5 12 8 6 7 4 6 3 4 5 7 5 13 3 3 3 2 2 4 4 7 4 5 7 8 24 74 19 7 13 5 8 6 73 12 4 20 26 4 3 1 1 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 4 1 1 3 3 2 1 3 4 1 1 3 3 1 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 0 2 4 2 0 2 4 2 0 3 4 3 1 3 4 3 1 3 4 1 2 3 3 2 1 3 3 1 1 3 3 2 1 3 3 1 2 3 3 1 2 4 3 1 2 4 3 1 3 4 3 3 3 5 4 4 5 5 4 11 13 11 14 27 17 13 29 100 30 22 9 4 4 5 2 2 3 3 2 1 4 3 3 3 7 17 21 19 33 25 16 9 6 3 2 2 3 4 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 1 1 3 3 1 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; 1HNMR: 86 86 d 1H J 29 \| 80 80 d 1H J 10 \| 75 74 m 3H \| 73 73 d 1H J 31 \| 71 70 m 2H \| 55 55 q 2H J 9 \| 40 39 dddd 1H J 22 49 62 71 \| 39 38 m 2H \| 38 37 ddd 1H J 30 58 119 \| 36 35 m 2H \| 33 33 d 1H J 62 \| 21 20 ddt 1H J 31 57 141 \| 18 17 dtd 1H J 30 59 141	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CON(C(=O)c1cn(C)nc1C(F)F)C(C)Cc1ccc(Cl)cc1Cl	ir: 28 7 9 5 11 10 9 3 5 2 4 4 2 1 1 3 8 11 7 4 2 1 1 3 3 1 0 5 5 2 1 6 6 2 0 1 1 1 2 8 7 4 7 6 45 53 52 60 43 11 5 9 13 3 24 100 13 3 7 5 25 9 14 4 6 14 13 30 12 7 26 10 23 11 8 14 13 12 34 18 2 6 3 5 7 13 7 3 1 4 1 5 13 18 3 9 15 15 13 10 3 4 4 4 3 3 3 5 5 7 4 8 6 6 7 6 5 6 11 10 14 8 19 19 10 6 4 11 6 5 9 1 1 1 4 2 1 3 4 3 1 7 25 5 71 10 10 7 32 28 74 26 10 4 2 2 2 2 3 6 11 4 1 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 1 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 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 2 2 3 6 2 4 3 4 1 5 7 5 6 10 16 10 13 20 12 77 81 44 25 39 21 11 8 4 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 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 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; 1HNMR: 78 77 s 1H \| 73 73 m 2H \| 72 71 m 2H \| 44 43 h 1H J 76 \| 39 38 s 3H \| 36 36 s 3H \| 32 31 dd 1H J 78 148 \| 30 29 dd 1H J 77 148 \| 14 13 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)c1cc2c(Nc3ccc(F)cc3OC3CCOCC3)ncnc2s1	ir: 3 2 2 2 3 2 2 3 6 3 7 2 3 5 8 18 39 12 14 3 4 4 4 4 4 2 11 9 16 5 2 2 3 3 4 3 5 7 18 60 65 13 33 13 8 9 5 0 2 4 6 3 4 9 17 18 2 2 3 6 3 2 2 1 1 2 3 5 10 3 1 2 2 3 5 1 5 3 2 3 2 1 2 3 2 1 1 1 1 1 2 1 1 2 1 2 1 1 5 12 2 22 6 3 2 2 2 1 3 6 2 2 6 4 2 2 3 2 7 8 83 14 4 5 1 7 5 2 5 1 1 2 3 11 8 3 2 1 1 1 1 2 1 6 2 4 100 27 7 4 85 10 10 12 8 32 8 5 3 27 19 2 1 19 2 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 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 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 3 2 1 2 3 2 4 9 6 4 13 10 6 11 3 3 2 1 1 1 1 1 1 1 1 2 2 2 2 2 2 3 5 5 10 33 26 4 2 3 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 1 1 1 1 1 1; 1HNMR: 85 85 s 1H \| 81 81 d 2H J 108 \| 73 72 dd 1H J 46 79 \| 69 69 ddd 1H J 22 79 101 \| 67 67 dd 1H J 22 122 \| 49 48 p 1H J 50 \| 39 39 s 2H \| 38 37 ddd 2H J 37 63 112 \| 37 36 ddd 2H J 37 63 112 \| 22 21 dddd 2H J 37 50 62 141 \| 20 19 dddd 2H J 37 50 62 141	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1c(N2CCCCCCCC2)[nH]c2cccnc12	ir: 3 4 28 9 4 2 2 1 1 1 8 9 4 6 1 2 4 3 1 10 36 8 3 3 3 8 11 90 30 12 5 1 5 3 7 14 47 77 20 3 22 13 3 5 2 1 1 2 4 0 11 8 3 5 1 2 1 1 5 15 4 1 24 11 1 2 1 2 2 0 2 6 1 1 3 3 2 1 2 2 4 100 8 9 16 11 8 2 4 9 5 2 2 1 2 4 8 4 3 4 3 2 1 2 1 20 16 24 31 12 19 13 6 4 3 2 3 4 4 5 11 5 6 2 2 2 1 2 1 2 3 2 9 11 6 18 23 11 12 2 1 1 2 6 4 2 1 12 28 1 1 1 2 12 89 72 5 5 3 19 2 2 2 0 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 0 5 29 1 2 0 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 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 0 1 1 1 1 1 2 2 2 6 9 4 5 4 2 2 2 2 3 14 10 12 10 20 10 5 2 2 1 1 1 1 1 1 1 1 1 1 2 1 2 3 5 4 5 2 5 7 13 57 31 3 3 9 5 3 1 2 2 2 1 1 1 1 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 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; 1HNMR: 91 91 s 1H \| 88 87 dd 1H J 20 40 \| 78 77 dd 1H J 22 79 \| 73 73 dd 1H J 40 79 \| 35 34 t 4H J 59 \| 17 17 tt 4H J 58 69 \| 15 15 m 4H \| 14 13 m 2H \| 14 14 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ncc(C(=O)/C(F)=C/N(C)C)n1C1CCC1	ir: 6 8 9 9 3 5 12 21 59 30 41 28 12 5 5 5 3 4 2 3 6 7 9 9 3 3 5 9 1 3 2 2 3 1 5 18 8 8 5 8 6 11 8 6 60 31 67 23 7 3 5 11 4 0 2 4 7 4 3 7 4 15 7 36 19 34 42 48 32 52 11 8 9 5 7 6 5 4 4 4 5 2 5 2 2 16 10 16 18 18 49 44 48 16 6 2 2 2 6 9 8 13 22 41 40 15 15 55 33 13 10 17 7 6 4 9 8 9 8 9 22 11 9 9 30 15 6 14 27 47 27 39 43 17 5 31 100 60 71 57 11 8 8 10 17 25 10 33 8 29 8 0 3 4 3 2 4 1 9 44 28 54 12 5 2 3 2 0 1 2 1 0 1 2 1 0 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 0 1 1 1 1 1 2 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 2 1 1 2 1 1 1 2 1 1 4 7 1 1 2 4 12 15 20 10 13 0 27 20 14 75 44 44 21 5 5 3 3 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 1 1; 1HNMR: 79 79 s 1H \| 70 69 hept 1H J 10 \| 69 69 hept 1H J 11 \| 46 45 p 1H J 36 \| 29 29 d 6H J 10 \| 25 25 s 3H \| 22 21 m 2H \| 19 18 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(F)ccc1-c1c(/C=C/C(=O)O)c2ccccc2c(=O)n1C(C)C	ir: 3 2 2 1 1 1 1 5 9 5 15 5 6 2 4 4 2 1 3 2 7 17 27 14 4 2 2 1 1 2 3 3 21 9 2 5 2 1 1 1 1 5 6 30 7 3 6 12 3 1 1 1 1 12 6 5 13 8 2 0 2 5 4 1 4 8 6 10 3 4 2 2 2 2 3 2 5 24 100 58 22 17 14 4 6 5 3 5 5 1 1 0 1 7 2 2 2 1 0 2 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 2 1 3 6 3 4 9 11 4 10 1 6 12 7 3 5 6 28 5 2 2 4 2 1 3 15 1 4 10 27 3 7 8 9 4 3 2 7 3 3 1 12 3 1 1 4 8 10 1 5 4 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 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 1 2 1 0 1 1 0 0 1 1 3 2 1 2 7 11 22 10 30 30 8 3 2 1 0 1 1 33 36 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 0; 1HNMR: 82 81 dd 1H J 16 83 \| 80 80 dd 1H J 16 81 \| 79 78 d 1H J 168 \| 77 77 td 1H J 16 80 \| 76 75 m 2H \| 70 69 ddd 1H J 21 88 101 \| 67 66 dd 1H J 21 121 \| 63 62 d 1H J 168 \| 47 46 p 1H J 73 \| 39 38 s 3H \| 14 14 d 7H J 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
ClCc1cnc(Nc2ccc(Cl)c(Cl)c2)nc1	ir: 8 6 6 8 8 6 6 8 7 6 7 8 8 6 7 15 19 7 6 7 8 8 10 12 21 43 57 29 14 9 8 11 11 9 11 41 40 97 54 35 40 39 37 10 10 8 8 9 8 11 7 7 17 66 40 30 8 5 7 8 6 5 6 8 6 6 9 23 10 6 6 6 6 6 6 6 6 6 6 6 7 6 7 6 6 7 6 10 15 7 6 7 7 8 16 27 12 15 9 7 6 7 6 8 25 32 16 9 5 6 9 13 5 6 7 6 5 6 7 10 5 8 8 7 11 11 12 19 9 7 7 6 5 6 6 5 5 10 9 6 7 16 90 16 10 7 14 65 22 25 47 21 33 18 17 18 9 5 7 75 6 0 91 50 7 14 7 2 6 9 6 3 6 8 6 4 6 7 5 4 6 7 5 4 6 7 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 6 5 6 7 6 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 6 7 6 5 6 7 6 5 6 10 9 11 19 29 38 18 10 10 8 6 6 7 7 6 6 6 7 6 6 6 6 8 7 6 7 13 15 18 29 100 90 12 7 7 7 7 5 5 6 6 5 5 7 6 5 5 6 6 5 6 7 6 5 6 6 6 5 5 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5; 1HNMR: 85 84 s 1H \| 84 84 t 2H J 9 \| 78 78 d 1H J 21 \| 74 74 d 1H J 78 \| 74 73 dd 1H J 21 78 \| 48 47 t 2H J 8	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Cl)cc1C(=O)/C=C1\SC(C(C)(C)O)=C(C)N1CC1CCC1	ir: 4 2 3 3 0 3 2 1 1 2 2 2 2 6 2 1 3 2 2 1 1 2 2 1 0 1 2 1 1 3 1 1 1 3 4 1 1 1 2 1 3 5 4 3 1 6 2 1 1 1 2 0 3 50 3 2 5 3 2 5 2 3 3 10 3 2 2 1 10 2 2 7 5 6 7 5 10 15 5 12 7 6 9 11 4 3 3 1 2 3 1 1 1 2 0 8 2 4 1 6 5 5 1 3 3 2 1 1 2 1 1 1 5 8 1 2 6 12 3 3 2 4 2 5 2 2 1 2 4 3 4 2 2 2 3 1 4 3 2 2 2 2 1 3 1 3 14 12 3 2 10 4 3 14 1 2 1 2 3 7 2 0 4 3 1 1 1 2 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 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 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 2 1 2 1 2 2 1 1 2 1 4 5 2 2 3 3 9 9 7 14 13 11 10 3 2 3 5 8 100 4 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 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 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; 1HNMR: 79 79 d 1H J 24 \| 75 74 dd 1H J 25 87 \| 71 70 d 1H J 86 \| 64 64 s 1H \| 39 38 s 3H \| 38 37 d 2H J 46 \| 33 33 s 1H \| 22 21 dddd 1H J 12 34 57 116 \| 21 21 s 3H \| 18 17 m 5H \| 17 16 m 2H \| 15 14 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1CCC2C(C)C=COC2C1	ir: 4 1 2 2 5 3 26 3 2 2 11 15 8 2 2 1 1 1 3 5 7 5 1 1 1 1 1 1 1 1 1 2 1 1 1 4 5 9 29 0 1 8 29 18 2 2 2 2 13 3 1 0 1 5 5 12 11 3 1 0 3 7 7 6 7 8 13 6 2 3 5 2 2 2 4 9 14 3 2 2 5 2 2 6 13 7 8 7 5 3 0 0 3 2 0 1 5 13 0 31 3 24 15 23 21 21 16 24 27 20 9 4 10 13 7 7 8 8 6 9 6 9 18 7 4 6 4 6 4 4 5 5 5 3 2 5 6 5 16 51 37 3 3 2 10 11 2 1 1 1 1 1 1 1 1 0 2 9 7 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 2 1 1 1 1 1 1 1 2 3 3 5 8 4 11 6 14 17 9 7 6 5 11 11 38 30 100 40 56 32 68 7 3 0 3 4 1 0 1 2 1 1 3 3 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; 1HNMR: 63 63 dt 1H J 17 81 \| 52 51 m 1H \| 41 41 dtd 1H J 18 49 68 \| 24 23 tqd 1H J 18 64 75 \| 19 18 m 2H \| 18 17 m 2H \| 17 16 ddd 1H J 48 75 132 \| 16 14 m 2H \| 13 12 dddd 1H J 51 61 77 130 \| 10 10 dt 3H J 12 64 \| 8 8 d 3H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(C(=O)NC2(C(=O)O)Cc3ccc(F)cc3C2)c1CC(C)C	ir: 5 8 5 2 3 2 3 3 5 5 4 12 5 12 7 4 5 4 10 9 69 76 40 100 27 57 17 7 10 6 6 2 4 6 4 7 12 20 20 39 29 35 10 1 9 10 11 22 8 4 5 4 8 8 7 4 2 6 4 1 13 5 5 1 4 3 10 19 3 4 6 2 3 5 8 7 10 18 26 27 10 9 6 8 6 16 4 8 8 28 9 10 27 15 10 2 4 2 0 1 2 2 1 4 2 2 0 1 3 2 2 7 11 9 3 6 19 6 12 3 3 4 2 2 3 4 2 3 4 5 5 3 2 2 2 2 7 11 22 20 25 12 21 30 35 31 37 24 13 9 11 8 4 1 2 2 2 1 6 3 1 2 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 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 2 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 2 1 1 1 1 2 5 4 5 2 3 1 5 10 11 3 24 45 41 10 3 0 2 2 2 1 20 89 17 8 4 3 3 2 2 1 1 1 2 4 9 50 28 5 2 1 2 2 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 1 1 1 1 0 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; 1HNMR: 77 76 s 1H \| 76 76 dd 1H J 18 71 \| 73 72 m 2H \| 71 70 ddt 1H J 9 47 79 \| 70 69 ddd 1H J 24 78 103 \| 69 68 ddt 1H J 9 26 122 \| 36 35 m 2H \| 33 32 m 2H \| 29 28 d 2H J 74 \| 23 23 d 3H J 7 \| 19 18 dp 1H J 70 140 \| 10 9 d 6H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(-c2cc(NC(=O)CC(C)CN3CCCCC3)[nH]n2)cn1	ir: 5 5 6 19 4 7 2 4 4 2 1 5 23 6 3 2 4 5 5 3 7 2 4 2 6 1 0 4 4 2 2 5 13 16 35 6 4 3 2 1 2 2 2 3 6 13 6 5 5 7 6 5 15 44 29 32 24 15 11 6 5 3 2 4 2 3 3 5 7 7 10 20 26 26 11 3 12 7 4 7 6 20 6 4 6 7 8 6 3 6 8 15 2 3 3 3 1 3 8 3 9 42 11 3 4 5 11 4 3 42 13 9 8 10 5 3 2 3 4 5 6 7 7 13 25 20 7 8 11 5 6 5 2 3 3 3 83 16 6 2 4 5 2 2 5 49 49 9 13 14 3 19 3 2 2 1 2 2 2 2 7 9 6 4 100 4 6 3 4 1 2 2 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 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 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 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 5 3 3 2 2 1 5 3 3 10 11 12 8 5 20 28 7 6 2 2 2 2 2 3 2 6 5 3 2 2 3 4 2 3 3 24 82 47 30 67 70 11 6 6 6 7 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; 1HNMR: 96 95 s 1H \| 94 94 d 1H J 19 \| 83 83 dd 1H J 19 83 \| 75 74 dd 1H J 9 83 \| 67 67 s 1H \| 27 26 d 3H J 7 \| 26 25 m 7H \| 24 23 dd 1H J 57 115 \| 23 22 m 1H \| 21 19 ht 1H J 56 79 \| 16 15 m 4H \| 15 14 m 2H \| 10 10 d 3H J 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)NC(C(=O)O)C(C)(C)CCc1ccccc1	ir: 2 3 4 2 1 2 3 3 3 8 5 6 4 5 7 3 2 8 6 3 14 100 59 7 6 3 2 5 10 14 48 20 24 7 4 4 3 6 3 22 25 1 3 6 4 1 1 2 2 0 1 2 2 1 1 2 2 0 2 4 2 0 5 4 2 2 8 2 2 2 3 2 1 2 2 2 4 18 15 31 3 0 3 3 1 1 4 7 7 3 5 1 1 2 3 2 1 3 10 4 4 3 4 2 2 2 2 1 1 2 3 1 1 2 2 3 2 9 5 8 7 10 5 4 8 8 8 2 3 6 6 11 7 4 3 10 5 5 5 3 3 5 13 34 14 32 6 4 6 21 9 5 9 2 2 1 1 1 2 2 1 1 1 1 1 1 1 0 1 2 1 0 1 2 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 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 1 1 1 1 1 1 1 1 1 1 1 1 1 2 4 2 1 2 2 2 1 2 2 4 3 5 7 22 7 8 13 10 6 3 2 2 1 3 2 11 32 4 2 2 1 1 1 1 1 1 2 1 2 3 7 30 21 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; 1HNMR: 73 72 m 3H \| 72 71 ddt 2H J 9 15 75 \| 62 62 d 1H J 88 \| 43 42 ddq 1H J 15 29 89 \| 27 26 m 2H \| 18 17 dt 1H J 77 146 \| 16 16 dt 1H J 77 146 \| 14 14 s 7H \| 11 11 d 3H J 16 \| 10 10 d 3H J 16	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1ncc(Cl)c1-c1cnc2c(c1)CN([C@H](CN)Cc1cccc(F)c1)C2=O	ir: 2 1 1 1 2 2 3 2 3 4 5 3 4 6 2 1 2 1 1 4 2 2 1 2 2 2 8 18 4 1 3 6 24 5 2 5 4 7 1 2 3 1 1 2 3 10 5 29 8 3 5 0 6 7 5 11 46 5 3 4 7 6 3 6 2 1 3 12 9 3 12 10 11 16 21 4 4 3 3 3 2 2 7 3 4 11 5 1 1 8 3 3 7 1 1 2 9 2 9 3 3 2 3 6 3 3 2 20 4 1 3 2 1 2 3 2 1 3 3 3 15 8 7 4 6 5 14 10 45 25 13 14 10 14 21 15 15 8 4 11 9 5 3 14 3 11 1 1 1 1 1 2 14 16 24 3 2 1 1 2 5 1 2 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 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 1 1 1 2 2 3 1 1 2 2 3 2 5 5 4 7 46 12 3 2 3 1 1 2 2 1 1 3 4 14 29 32 15 7 5 6 5 6 100 81 3 2 1 2 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 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; 1HNMR: 86 86 d 1H J 16 \| 80 79 dt 1H J 9 16 \| 78 78 s 1H \| 73 72 td 1H J 50 79 \| 71 71 ddq 1H J 10 19 77 \| 70 69 m 2H \| 45 44 dd 1H J 7 146 \| 43 43 dd 1H J 8 147 \| 41 40 tt 1H J 49 73 \| 39 39 s 2H \| 31 30 m 2H \| 29 27 m 2H \| 19 19 t 2H J 65	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(c1ccccc1)c1nc(N)nc(-c2noc(-c3ccc(OCC#N)nc3)n2)n1	ir: 2 3 7 4 3 3 3 3 3 4 2 2 1 2 3 2 3 2 4 3 3 3 3 2 1 1 1 1 2 1 2 2 2 1 3 14 2 2 2 1 3 5 4 1 4 1 2 1 1 1 1 0 0 2 7 0 4 5 7 8 28 21 6 7 5 2 2 4 3 5 3 3 1 2 1 1 1 4 3 3 1 1 1 1 2 1 1 1 1 1 1 4 1 1 1 0 1 1 1 9 1 0 0 1 1 0 0 1 1 1 4 1 1 1 0 0 1 1 1 2 1 0 1 1 5 1 0 1 1 2 1 6 3 4 2 2 2 14 7 2 3 13 3 11 4 9 10 2 7 37 27 12 9 3 2 1 1 1 1 1 2 7 40 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 3 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 1 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 1 1 1 5 6 6 11 5 6 3 1 1 1 1 0 0 1 0 0 0 1 1 0 1 6 8 2 1 1 0 0 1 1 0 0 2 1 100 2 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 0 0 0 0 0; 1HNMR: 88 88 d 1H J 19 \| 83 83 dd 1H J 19 83 \| 74 73 m 5H \| 71 70 tt 1H J 16 75 \| 69 69 d 1H J 83 \| 68 68 s 2H \| 50 50 s 2H \| 35 35 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=S(=O)(Nc1cncc(-c2ccc3ncnc(OC4CCOCC4)c3n2)c1)c1ccc(F)cc1Br	ir: 1 2 2 1 0 2 12 9 10 13 5 7 5 4 6 8 10 6 5 6 12 3 2 2 8 3 9 8 5 6 9 12 38 24 27 2 3 1 1 2 1 1 1 1 2 6 3 1 4 1 15 7 2 5 16 15 50 11 8 2 3 1 1 6 12 4 11 12 3 1 1 1 4 1 1 6 3 1 2 1 3 11 23 10 3 19 54 1 1 1 1 2 9 3 2 0 1 6 51 1 2 6 3 2 1 1 0 3 7 8 14 11 42 7 2 3 5 3 4 4 5 6 8 6 12 15 15 10 28 22 1 8 10 12 4 2 3 100 10 1 1 1 1 1 1 3 11 1 4 6 2 16 9 17 5 2 1 4 5 16 7 3 4 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 1 0 0 1 1 1 1 1 1 1 1 1 2 2 15 7 9 14 18 8 6 1 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 2 4 1 2 8 15 73 19 3 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; 1HNMR: 90 90 s 1H \| 89 89 t 1H J 17 \| 86 85 s 1H \| 85 84 t 1H J 16 \| 83 83 t 1H J 17 \| 83 82 m 2H \| 80 79 dd 1H J 46 92 \| 75 75 dd 1H J 22 121 \| 73 72 ddd 1H J 21 92 101 \| 50 49 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 55 64 141 \| 20 19 dddd 2H J 37 55 64 141	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCC1CCCCN1CCCOc1ccc(C(=O)c2ccccc2OC)cc1	ir: 6 11 12 4 6 3 1 2 5 4 2 1 4 9 4 1 2 5 10 6 5 23 3 2 4 6 5 3 26 12 3 4 3 4 3 3 15 10 11 48 26 18 47 80 12 11 10 1 2 2 3 3 3 8 8 2 50 18 10 3 6 9 4 14 11 15 17 20 10 14 37 9 4 23 12 13 4 8 6 6 4 6 20 27 4 2 4 19 37 8 6 2 2 3 2 4 3 4 5 2 4 21 4 2 3 3 4 2 6 5 13 20 29 7 17 15 14 9 13 15 4 22 16 22 8 61 36 7 6 3 3 3 7 11 8 19 70 43 24 8 2 15 6 4 9 33 21 4 35 46 32 51 5 4 3 8 2 1 2 17 8 4 21 8 2 1 0 0 1 1 1 0 1 1 0 0 0 1 1 0 0 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 1 1 0 1 1 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 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 1 1 1 1 1 5 3 2 2 6 7 4 3 3 4 4 3 9 16 24 10 60 100 43 17 14 1 3 3 1 4 2 1 1 0 2 2 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 dd 1H J 15 79 \| 79 78 m 2H \| 74 73 m 1H \| 70 70 m 4H \| 41 40 t 2H J 64 \| 38 38 s 2H \| 28 27 m 2H \| 27 26 m 2H \| 26 25 m 1H \| 19 19 m 1H \| 19 17 m 2H \| 16 15 m 5H \| 14 13 m 2H \| 9 8 td 3H J 15 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OC)c2c(Oc3ccc(F)cc3)nc(Nc3cc(C)[nH]n3)cc2c1	ir: 3 3 3 2 2 3 1 3 3 3 4 3 3 3 3 3 2 3 2 2 3 3 3 5 5 11 9 8 6 8 7 34 35 9 8 9 8 3 3 2 4 2 3 3 2 10 6 23 100 20 16 13 17 6 28 11 8 8 2 4 2 2 4 4 5 3 24 9 6 16 16 21 22 30 7 8 4 3 3 2 2 3 2 2 2 2 2 4 2 2 2 2 1 1 2 2 1 7 38 6 6 6 4 3 13 6 8 4 3 2 3 2 1 2 2 1 4 2 3 2 2 5 6 5 4 9 6 8 2 2 2 1 1 2 2 4 3 2 4 3 3 20 2 2 11 20 10 22 4 2 3 8 6 13 8 0 2 6 36 36 52 17 4 4 3 2 2 54 10 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 1 1 1 1 1 2 1 1 1 2 1 1 1 2 3 1 2 4 6 7 10 54 58 13 6 2 3 5 2 2 2 3 2 1 1 2 2 1 1 1 2 3 4 5 23 6 31 34 21 13 4 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; 1HNMR: 93 93 s 1H \| 84 84 s 1H \| 75 75 d 1H J 22 \| 73 72 m 5H \| 71 71 t 1H J 21 \| 65 64 d 1H J 22 \| 58 58 s 1H \| 40 39 s 3H \| 39 38 s 3H \| 23 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(CN1C[C@@]2(CCC[C@H](Cn3cnc4ccc(C#N)cc43)C2)OC1=O)C(=O)O	ir: 2 4 8 4 2 2 4 3 2 2 3 11 3 14 3 3 3 2 4 5 5 7 26 23 7 4 4 3 4 4 4 4 3 2 9 3 2 6 8 3 15 7 7 3 2 2 2 3 2 4 2 2 2 2 5 22 4 4 4 5 3 2 3 5 3 3 5 8 6 2 2 2 2 3 5 4 4 3 18 3 4 3 8 10 3 2 3 2 3 4 3 3 3 2 2 3 4 5 7 8 5 5 6 3 3 3 4 6 4 5 2 2 2 2 3 6 7 4 6 6 28 9 6 8 9 3 2 4 5 3 3 3 3 2 3 4 3 3 2 3 2 3 3 6 16 12 5 3 2 3 6 13 2 2 2 2 2 1 2 2 1 1 3 2 1 1 1 2 1 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 1 1 2 2 1 1 2 1 1 2 2 1 1 1 2 2 1 2 3 2 1 2 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 2 1 2 2 2 2 2 3 3 3 3 2 2 2 3 3 12 6 7 3 11 15 4 2 0 3 5 4 3 100 70 15 6 3 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 1 1 1 2 1 1 1 2 1 1 1 2 2 1 1 2 2 1 1 2 1 1 2 1 2 1 1 2 1 1 2 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; 1HNMR: 80 80 d 1H J 9 \| 80 79 d 1H J 19 \| 78 78 d 1H J 63 \| 78 77 dd 1H J 21 63 \| 41 41 ddd 1H J 10 71 139 \| 39 38 m 3H \| 36 35 d 1H J 125 \| 33 33 d 1H J 125 \| 21 20 dd 1H J 51 132 \| 19 17 m 5H \| 17 16 dddd 1H J 42 50 79 121 \| 16 14 m 3H \| 13 12 d 6H J 38	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(C(=O)O)C2CCC(C2)C12CC2	ir: 1 1 1 1 0 1 1 1 1 1 3 5 20 8 5 3 5 2 5 3 4 10 100 67 26 4 5 3 5 1 1 2 1 1 0 1 0 0 0 1 1 4 2 4 3 1 2 3 1 1 1 1 2 1 2 2 1 1 1 1 1 2 1 1 1 0 1 1 1 1 1 1 1 1 1 2 8 29 2 6 21 6 15 3 1 1 4 5 2 4 2 3 7 2 1 1 0 3 1 1 0 1 1 2 1 1 1 1 8 3 10 11 6 4 3 1 2 2 2 2 2 2 3 2 2 2 2 4 7 2 2 1 1 3 2 1 1 1 1 1 1 2 2 1 26 10 2 1 1 1 1 2 2 2 1 0 0 0 0 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 1 2 3 13 2 6 7 6 1 1 1 3 3 4 2 2 1 1 4 39 3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 32 31 ttq 1H J 15 42 56 \| 19 17 m 3H \| 17 16 dddd 1H J 18 41 59 128 \| 16 15 m 2H \| 15 14 dddd 1H J 18 41 59 130 \| 12 12 d 3H J 15 \| 12 11 m 2H \| 9 8 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc(NC(=O)Cc2ccccc2)c(C)c(C)c1OCc1ccccc1	ir: 2 3 2 2 2 3 5 2 4 3 3 3 1 2 7 15 7 8 8 9 13 14 15 15 23 8 11 10 18 15 21 43 44 17 17 13 18 10 43 84 46 25 7 3 4 4 3 4 3 5 2 8 7 3 6 2 2 2 2 1 2 2 4 8 4 5 7 2 16 11 5 2 5 1 3 2 3 8 5 7 2 1 2 2 1 1 2 2 6 13 3 3 2 1 1 4 5 9 8 4 5 15 1 1 2 2 9 3 2 2 2 2 1 1 2 5 21 8 3 7 15 3 10 4 2 7 4 3 3 3 2 3 8 13 37 22 17 6 3 2 4 8 18 29 96 35 40 8 11 8 5 4 15 100 14 9 2 1 1 5 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 3 4 1 1 2 4 3 2 3 5 2 2 6 15 15 13 65 54 32 22 11 4 4 5 2 3 4 4 1 1 1 1 1 2 3 3 3 6 4 7 14 25 52 14 4 2 2 1 0 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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: 87 87 s 1H \| 74 74 dq 2H J 10 73 \| 74 73 m 2H \| 73 73 m 3H \| 73 72 m 2H \| 73 72 s 2H \| 51 51 t 2H J 9 \| 37 37 t 2H J 8 \| 24 24 s 2H \| 22 21 s 2H \| 21 21 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1cc(CBr)cc(COc2ccccc2)c1	ir: 13 3 1 2 2 1 0 1 2 2 1 1 2 2 1 1 1 2 3 1 1 3 1 1 1 1 2 2 5 2 5 9 2 2 6 4 2 1 3 18 22 20 4 4 4 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 4 2 6 2 4 9 7 24 5 1 4 3 3 6 3 2 2 5 2 2 1 1 1 1 5 4 3 1 1 2 2 3 9 5 2 3 7 3 1 2 1 1 1 2 2 4 7 3 2 1 1 2 4 1 3 4 11 4 4 1 2 3 1 4 4 6 12 19 6 10 3 1 4 14 12 35 2 1 1 1 3 4 70 14 8 42 5 2 1 4 18 23 3 1 2 1 1 1 41 3 1 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 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 0 1 0 0 0 1 1 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 0 1 1 0 0 1 1 1 1 1 1 1 1 1 2 2 2 2 1 1 1 4 4 9 10 9 33 100 26 27 7 3 2 2 1 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 0 0 0 1 0 1 1 1 0 1 1 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 1 0 0 0 1 0 0 0 1 0 0 0 0 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; 1HNMR: 79 79 dhept 2H J 10 29 \| 73 73 m 3H \| 70 70 tt 1H J 15 75 \| 70 69 m 2H \| 51 51 t 2H J 8 \| 45 45 t 2H J 8 \| 44 44 q 2H J 64 \| 14 14 t 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CC(C)C(=O)O)cc1	ir: 2 1 2 3 2 4 4 3 7 6 11 10 15 11 16 21 15 15 42 42 39 59 57 8 9 13 8 2 2 5 3 2 2 2 2 2 6 5 2 1 1 2 2 5 3 3 2 5 5 4 3 2 5 7 12 18 25 4 3 2 3 5 4 13 2 1 3 2 2 6 3 3 6 6 6 26 29 37 81 44 13 7 9 3 5 7 6 11 14 6 3 2 1 3 3 2 5 8 7 5 5 1 1 1 1 2 2 3 4 3 0 1 2 1 3 2 8 7 6 4 2 4 3 3 3 1 7 4 1 1 1 6 7 4 2 1 1 2 2 2 6 7 7 51 12 6 8 8 36 7 7 10 9 5 3 2 1 0 0 1 0 0 1 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 0 0 1 1 1 1 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 1 1 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 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 2 2 2 2 2 3 3 14 8 13 42 100 45 4 4 3 4 3 3 2 21 54 14 3 2 1 1 0 1 1 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 0; 1HNMR: 71 70 dt 2H J 9 86 \| 68 68 m 2H \| 38 38 s 2H \| 31 30 ddt 1H J 9 77 132 \| 28 27 m 2H \| 12 11 d 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1ccc(N2CCNc3ccccc32)cc1	ir: 2 1 1 1 2 1 1 1 1 1 1 3 3 2 1 2 2 2 3 2 3 6 13 2 2 2 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 7 3 1 1 1 1 1 1 1 1 1 2 3 4 1 2 2 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 3 3 2 9 4 5 1 1 1 2 4 1 1 3 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 2 1 1 1 2 5 2 2 1 1 1 2 1 2 1 2 1 1 1 1 1 1 1 1 2 4 3 1 1 1 1 6 4 5 2 4 2 1 1 2 5 4 2 2 2 1 1 1 1 1 1 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 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 2 2 2 4 7 5 2 2 2 1 0 3 4 8 100 4 1 2 2 1 1 1 2 1 1 2 4 3 6 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; 1HNMR: 79 79 m 2H \| 71 71 m 2H \| 71 70 td 1H J 13 73 \| 70 70 m 1H \| 70 69 ddd 1H J 19 75 82 \| 68 67 dd 1H J 14 82 \| 51 50 t 1H J 33 \| 39 38 m 2H \| 35 35 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(c1ccc(OCC(F)(F)F)cc1)N1CCC2(CC1)Oc1ccccc1-n1cccc12	ir: 6 5 5 4 5 3 1 3 6 6 3 3 7 4 2 4 5 3 3 4 2 1 3 7 1 2 1 3 5 2 2 8 2 10 6 4 7 4 7 18 18 63 73 91 14 5 7 1 2 2 2 1 3 6 4 7 45 21 6 5 2 2 2 2 2 5 7 9 8 14 2 4 6 2 3 2 2 1 3 5 26 6 2 0 3 4 3 12 6 12 4 3 2 2 5 4 1 1 3 1 5 12 10 4 7 8 3 1 2 2 1 2 5 7 0 5 6 6 6 12 8 19 12 14 11 16 8 11 11 8 2 4 4 8 10 10 8 5 0 15 9 79 20 4 7 22 12 4 5 13 47 11 5 5 4 2 2 1 1 1 1 1 16 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 0 1 1 1 1 1 0 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 0 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 4 6 3 4 1 4 3 2 4 8 16 21 32 100 31 45 36 20 22 14 5 4 2 1 1 1 1 1 1 1 1 1 1 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 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 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 79 78 m 2H \| 77 77 dd 1H J 16 35 \| 76 75 m 1H \| 73 72 m 2H \| 70 70 m 2H \| 68 68 m 1H \| 64 63 m 2H \| 48 47 d 1H J 130 \| 47 47 d 1H J 130 \| 39 38 ddd 2H J 35 62 126 \| 35 34 ddd 2H J 35 62 125 \| 27 27 ddd 2H J 34 61 130 \| 24 24 ddd 2H J 34 61 130	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)[C@H](OC1=C(C(C)=O)C(C2CCCCC2)N(c2ccc(Cl)cc2)C1=O)c1ccccc1	ir: 18 12 12 12 8 6 7 2 4 2 3 3 10 4 2 3 2 3 3 3 4 4 2 1 1 3 10 5 3 4 4 6 35 26 12 10 3 4 4 7 37 67 9 6 4 5 3 7 5 6 3 3 4 7 30 68 2 8 5 0 1 2 5 3 2 14 12 8 15 19 24 5 4 7 8 4 4 4 13 6 19 4 1 1 5 4 4 4 11 36 11 5 8 2 1 2 4 11 2 3 3 7 2 18 3 9 4 3 4 2 5 8 10 5 5 5 9 5 11 8 17 7 2 12 8 5 7 4 1 9 6 4 4 3 15 51 7 6 4 2 0 7 21 23 98 7 6 51 74 42 5 7 28 3 1 1 1 1 13 2 1 1 1 1 1 0 1 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 0 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 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 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 1 1 3 2 2 2 2 2 3 2 3 4 6 6 10 8 17 27 17 25 100 23 23 7 3 3 4 2 1 2 3 1 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 0 1 0 0 0 1 0 0 0 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; 1HNMR: 74 74 m 2H \| 74 72 m 5H \| 72 72 ddd 2H J 7 23 80 \| 61 60 d 1H J 9 \| 43 43 d 1H J 81 \| 38 37 s 2H \| 24 23 m 1H \| 23 23 s 2H \| 18 17 ddt 2H J 65 87 130 \| 16 13 m 9H	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(c2cc(=O)[nH]c3c4ccc(C(F)(F)F)cc4nn23)CC1	ir: 3 7 6 8 9 9 7 7 6 8 39 13 10 7 5 6 6 6 5 4 3 4 5 4 7 5 14 9 7 7 4 4 4 3 4 14 4 4 6 7 4 7 8 100 63 16 5 3 6 6 4 3 4 4 12 8 5 8 19 6 5 5 6 5 5 10 16 43 21 20 7 4 4 5 4 3 4 4 4 8 6 4 4 3 4 4 3 4 4 7 3 3 4 4 3 6 8 9 6 23 6 10 5 4 6 5 6 6 8 8 7 11 39 9 8 6 9 23 9 19 6 10 13 17 8 11 15 9 9 21 10 11 8 7 10 7 19 8 6 28 5 6 18 8 8 4 3 4 4 5 30 19 8 7 4 3 3 4 4 3 3 5 5 29 63 0 3 6 4 2 3 5 3 2 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 4 4 3 3 4 3 3 3 4 3 3 3 3 3 3 3 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 3 4 3 4 4 3 4 4 4 4 5 4 5 6 4 5 5 6 9 6 6 6 11 22 12 14 29 24 32 11 4 6 4 4 3 4 4 3 3 4 4 3 4 4 4 4 5 5 16 31 38 34 32 12 6 4 5 3 4 5 4 3 3 4 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 3 3 3 3 3 3 3 3 3 3 3; 1HNMR: 80 79 d 1H J 108 \| 78 78 dt 1H J 9 18 \| 77 76 dp 1H J 14 108 \| 61 60 d 1H J 18 \| 38 37 ddd 2H J 53 80 124 \| 35 34 ddd 2H J 52 80 124 \| 31 30 pd 1H J 17 59 \| 23 22 ddt 2H J 55 80 113 \| 20 19 dddd 2H J 53 59 80 113 \| 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)c1cc(-c2ccccn2)c(=O)n(C)c1	ir: 5 7 1 30 32 21 7 9 11 13 5 3 2 2 6 11 12 6 4 2 2 1 2 2 3 3 10 40 35 9 7 1 2 12 6 4 5 4 33 5 4 4 4 6 9 69 77 8 7 13 5 6 3 14 34 30 3 5 3 3 3 2 2 9 16 8 4 4 4 4 7 5 12 19 22 13 6 2 7 13 9 11 15 2 4 3 3 3 2 1 1 1 1 2 2 2 14 39 13 3 25 12 10 2 2 2 2 2 5 7 4 2 3 2 6 7 6 9 11 12 35 13 6 5 1 6 16 7 17 33 18 6 5 9 17 6 30 8 12 12 36 32 17 5 9 30 58 100 21 4 49 65 24 8 18 10 18 8 22 56 11 6 10 5 4 5 13 8 2 1 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 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 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 1 1 1 2 5 2 2 3 4 2 4 10 5 30 31 42 36 19 15 6 4 2 1 2 2 1 1 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 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: 90 89 t 1H J 12 \| 86 86 dd 1H J 16 42 \| 85 85 d 1H J 14 \| 77 77 td 1H J 16 75 \| 76 76 dd 1H J 14 78 \| 72 72 ddd 1H J 14 42 73 \| 37 37 s 2H \| 34 34 d 3H J 11	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#CCN1C(=O)CC[C@H]1Cc1ccc(-c2ccccc2)cc1	ir: 3 2 0 2 3 3 1 2 5 3 1 5 4 2 2 7 6 3 5 5 7 7 6 6 3 2 1 2 2 3 4 5 3 2 4 3 4 3 7 12 30 52 24 7 9 4 3 5 2 1 2 3 2 2 6 13 25 22 4 5 6 6 4 3 2 1 2 3 5 7 18 4 2 1 2 3 2 1 2 2 1 0 2 2 3 2 4 3 2 5 11 4 1 2 5 3 1 3 7 2 2 2 2 2 1 1 2 2 1 2 2 2 3 4 11 3 5 7 11 14 4 7 6 5 4 5 10 3 2 3 4 5 6 8 6 6 3 3 2 2 3 10 29 5 2 4 3 3 18 100 10 5 24 4 3 2 2 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 4 2 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 1 2 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 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 1 1 1 2 2 1 1 2 1 1 1 2 2 2 4 4 7 3 2 4 3 3 3 7 17 6 18 56 40 2 3 8 3 1 2 4 1 0 2 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 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 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 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 76 75 m 4H \| 75 74 m 2H \| 74 73 m 1H \| 72 71 dt 2H J 9 86 \| 45 44 d 1H J 101 \| 43 42 d 1H J 101 \| 40 40 m 1H \| 31 31 m 1H \| 27 26 m 1H \| 26 25 dddd 1H J 17 48 66 139 \| 25 24 ddd 1H J 48 66 140 \| 21 20 m 1H \| 18 17 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNC(=O)N1CCN(C(=O)CN2CCCC2=O)CC1	ir: 7 3 1 4 4 4 2 4 4 5 3 16 8 5 4 5 8 15 9 13 21 16 20 6 4 1 3 4 6 5 4 5 4 4 4 10 11 16 15 29 12 6 11 15 13 3 3 4 3 1 1 6 5 3 6 10 5 4 6 4 3 2 3 6 4 1 4 5 2 3 3 4 2 1 3 5 4 1 2 3 1 1 2 4 4 4 6 5 9 5 5 5 1 2 4 3 4 3 4 5 5 3 3 3 2 3 5 5 6 4 9 6 12 6 13 7 4 5 12 28 20 12 12 12 6 10 4 3 4 14 18 7 2 4 5 5 6 9 6 2 2 3 6 4 8 44 100 57 58 27 9 13 27 6 4 2 2 2 2 1 1 3 2 0 1 3 2 0 1 3 1 0 1 3 1 0 1 3 1 0 2 3 1 0 2 3 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 3 2 0 1 3 2 0 1 3 2 0 1 3 1 0 1 3 1 0 2 3 1 0 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 3 3 3 6 6 5 3 4 5 4 1 2 8 28 11 4 3 2 1 2 3 2 1 2 2 1 1 2 3 1 2 5 4 3 2 3 4 2 4 13 24 10 11 7 5 1 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 3 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 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0; 1HNMR: 56 55 q 1H J 55 \| 40 40 s 2H \| 37 36 m 4H \| 36 35 m 6H \| 28 28 d 3H J 55 \| 25 24 m 2H \| 20 19 tdd 2H J 35 43 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)NC(C)CCC1CCC(Oc2ccc(OC(C)C)nc2)CC1	ir: 2 4 8 6 16 10 3 3 2 1 3 2 4 10 5 7 7 6 4 6 7 11 12 3 1 3 3 5 11 13 32 74 53 54 24 31 5 10 5 4 6 2 4 1 2 3 1 0 4 8 5 7 5 31 60 18 17 7 4 1 3 1 4 3 1 2 4 3 6 54 25 10 12 6 6 6 5 3 5 4 5 12 4 5 3 3 2 3 24 5 2 3 4 6 0 7 3 3 1 2 3 3 2 1 4 5 8 8 9 17 21 17 11 13 6 26 19 17 10 14 17 8 6 9 6 9 11 10 10 11 5 4 6 4 7 4 8 92 29 11 5 9 20 20 40 100 92 31 12 26 4 5 11 1 2 4 2 1 2 4 48 2 3 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 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 2 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 2 2 1 1 2 2 1 1 4 17 2 2 3 8 14 6 6 8 4 12 11 18 27 65 30 12 15 55 7 5 3 2 2 1 1 1 2 1 1 1 2 1 3 3 9 4 10 10 51 32 47 55 11 11 5 5 3 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 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; 1HNMR: 80 79 d 1H J 20 \| 71 70 dd 1H J 20 88 \| 68 68 d 1H J 88 \| 65 64 d 1H J 79 \| 51 49 hept 1H J 61 \| 47 46 p 1H J 49 \| 39 38 dh 1H J 56 79 \| 20 19 m 2H \| 20 19 s 3H \| 17 16 m 5H \| 16 14 m 1H \| 15 14 m 2H \| 14 13 m 9H \| 12 11 d 3H J 57	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)c1ccc(C(CC2CCCC2)C(=O)Nc2ccccn2)cc1F	ir: 7 3 8 3 2 5 13 2 6 10 16 2 1 0 2 1 3 2 3 4 4 27 11 4 3 4 6 2 1 2 3 3 6 5 9 3 4 12 30 11 20 57 35 26 8 2 4 3 3 1 2 5 6 15 51 18 6 6 6 4 3 3 4 4 15 37 9 2 44 12 11 3 2 2 3 0 1 3 2 2 10 15 2 3 82 59 14 4 5 15 4 34 19 9 4 9 4 1 2 2 4 1 2 3 6 41 22 8 5 4 4 2 2 4 7 4 2 2 37 10 10 12 5 2 3 4 4 3 4 1 1 3 3 4 3 12 21 9 4 3 24 3 1 3 4 23 16 51 24 46 91 19 4 7 25 14 4 4 100 3 2 12 2 1 1 0 1 0 1 0 0 1 1 1 0 1 0 0 0 1 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 1 0 0 0 0 0 1 0 1 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 0 1 0 1 0 3 6 5 2 1 1 3 5 3 3 6 4 11 27 25 23 10 28 38 46 7 6 5 2 2 1 1 1 2 1 0 1 1 1 2 2 3 2 1 1 2 11 37 42 21 2 1 2 2 1 1 1 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; 1HNMR: 90 90 s 1H \| 82 82 dd 1H J 16 42 \| 79 79 dd 1H J 47 90 \| 78 77 m 2H \| 74 74 ddd 1H J 7 22 122 \| 74 73 m 1H \| 71 70 ddd 1H J 16 44 70 \| 37 37 m 1H \| 33 32 s 2H \| 22 21 ddd 1H J 69 76 146 \| 19 18 ddd 1H J 69 76 146 \| 18 17 m 1H \| 17 15 m 4H \| 15 14 m 2H \| 14 13 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Cn2cc(CO)nn2)cc1	ir: 9 8 3 8 13 8 5 11 19 12 8 11 12 5 3 11 10 7 3 8 7 3 2 7 8 4 3 8 14 4 8 11 12 4 3 7 7 6 6 8 5 1 4 8 6 2 5 12 7 3 18 11 13 18 22 51 24 10 22 17 19 16 12 27 10 32 25 11 8 5 7 8 4 2 5 7 3 4 6 7 5 2 8 7 18 33 48 75 21 62 34 28 16 13 15 23 7 5 16 22 5 4 7 5 1 4 9 4 0 3 7 4 0 4 8 4 1 6 11 11 6 7 12 9 9 13 15 13 7 11 11 7 4 6 5 2 2 5 5 3 3 5 5 4 4 5 5 36 67 36 16 3 19 33 62 11 4 8 5 1 3 8 7 0 3 7 4 0 3 7 4 0 4 7 3 0 4 7 3 0 4 7 3 1 4 6 3 1 5 6 2 1 5 6 2 1 5 5 2 2 5 5 2 2 5 5 1 2 6 4 1 2 6 4 1 3 6 4 1 3 6 4 1 3 6 4 0 3 7 3 0 4 6 3 1 4 6 3 1 4 6 3 1 4 6 3 1 5 5 2 2 5 5 2 2 5 5 3 3 7 5 2 3 7 5 3 3 7 6 2 4 7 6 2 7 9 7 1 5 12 10 5 8 14 22 25 37 100 41 18 45 28 25 45 50 78 66 16 20 12 11 6 5 6 4 3 5 5 3 3 6 5 3 3 5 6 2 3 5 5 2 3 6 5 3 3 6 5 2 3 6 4 1 3 6 4 1 3 6 3 1 3 6 3 1 3 6 3 1 4 5 3 1 4 5 3 1 4 5 3 2 4 5 2 2 4 5 2 2 4 5 2 2 5 4 2 2 5 4 2 2 5 4 2 3 5 4 1 3 5 4 1 3 5 4 1 3 5 3 1; 1HNMR: 78 78 p 1H J 9 \| 73 72 dt 2H J 8 74 \| 69 69 m 2H \| 55 54 q 2H J 9 \| 48 47 dd 2H J 8 56 \| 38 38 s 2H \| 32 31 t 1H J 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1sc2nc(Cl)nc(NCCc3ccc4c(c3)OCO4)c2c1C	ir: 14 7 1 4 7 2 1 2 3 1 1 2 2 3 5 4 4 5 2 6 4 4 3 2 2 1 1 3 2 1 1 2 2 1 1 3 2 1 2 10 16 21 10 4 2 1 2 2 2 1 1 3 3 3 4 2 2 1 2 3 1 1 2 3 5 6 2 5 13 3 1 2 1 1 2 2 1 1 1 1 1 0 1 1 1 1 2 2 0 1 1 2 2 1 1 1 0 1 4 1 1 1 2 4 3 3 3 1 0 1 3 1 0 1 2 2 2 6 9 3 6 5 5 4 1 2 4 1 3 3 5 3 2 6 7 3 4 2 2 2 15 6 11 17 2 2 1 1 1 1 5 1 1 5 2 100 19 4 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 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 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 0 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 2 2 1 1 2 1 0 1 2 1 0 2 3 3 2 4 18 6 1 1 2 1 1 1 2 1 0 1 2 1 1 2 2 1 1 1 3 2 2 6 8 11 14 8 5 3 3 2 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 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: 67 67 d 1H J 88 \| 67 66 ddt 1H J 9 17 87 \| 65 65 dt 1H J 9 18 \| 62 62 t 1H J 46 \| 59 59 s 2H \| 37 36 td 2H J 46 61 \| 30 29 tt 2H J 8 61 \| 24 23 s 3H \| 23 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H](N)C(=O)NOP(C)(=O)O	ir: 10 5 3 3 6 3 0 3 5 3 1 3 5 2 2 3 4 3 3 8 7 3 5 4 4 7 3 9 8 6 15 15 25 56 76 53 18 23 26 10 12 4 5 6 5 5 11 15 11 1 9 7 38 5 3 10 18 4 56 9 8 7 4 5 4 6 6 13 8 37 15 20 18 18 3 12 21 13 27 39 14 5 7 19 5 3 6 5 1 2 4 3 1 2 4 6 3 4 12 12 20 13 100 4 4 4 6 4 1 3 6 5 2 3 5 6 6 35 29 22 12 10 7 4 2 6 7 3 8 6 8 2 0 24 89 34 4 4 6 1 1 5 5 1 39 36 9 12 21 3 3 3 3 2 2 2 2 3 2 2 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 1 2 3 3 1 2 3 3 1 2 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 2 3 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 4 5 2 2 4 3 2 3 4 3 4 5 10 10 9 10 16 15 13 18 10 6 2 5 20 73 16 7 5 2 3 3 5 4 14 29 19 5 3 8 10 51 25 20 35 20 23 8 6 3 2 3 3 2 2 3 2 2 2 3 2 1 2 3 2 1 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 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 51 50 d 3H J 56 \| 41 40 h 1H J 53 \| 17 17 d 3H J 130 \| 14 14 d 4H J 53	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Clc1ccc2[nH]nc(Br)c2c1	ir: 1 13 6 7 6 5 4 4 5 4 4 4 8 7 8 5 7 6 6 7 5 4 4 4 4 4 4 6 6 4 4 4 6 8 5 5 4 4 4 4 4 4 4 3 4 4 4 3 4 5 4 6 17 86 52 10 4 1 4 5 4 3 5 7 7 5 5 16 48 15 4 4 3 3 4 4 3 3 4 4 3 4 5 7 7 4 4 4 4 5 6 4 4 3 4 4 4 7 21 42 6 5 7 4 3 4 6 23 31 21 21 4 3 4 5 3 0 25 33 4 4 3 3 4 3 4 4 3 3 4 6 7 3 4 4 4 3 5 7 34 37 13 57 32 5 3 3 3 4 4 4 3 100 58 17 6 4 4 4 4 4 4 3 6 5 4 4 3 4 4 3 3 3 4 4 4 3 3 3 3 4 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 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 4 3 3 3 4 3 3 3 4 3 3 3 3 3 3 3 4 3 3 3 3 3 3 4 3 3 3 3 4 3 3 4 4 4 3 3 3 3 4 4 4 4 3 4 4 3 4 4 4 4 3 5 4 5 5 8 9 12 32 75 48 23 8 5 18 7 6 5 7 4 4 3 4 4 4 3 5 4 6 4 4 4 4 15 25 37 24 21 5 4 6 5 5 6 6 9 9 9 6 5 4 3 4 4 3 4 4 4 4 4 4 4 3 4 4 4 4 4 4 3 3 3 4 3 4 3 4 3 3 3 4 3 3 4 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3; 1HNMR: 78 78 d 1H J 27 \| 76 76 d 1H J 79 \| 74 73 dd 1H J 26 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@@]1(C(=O)O)C[C@H]1c1ccccc1	ir: 2 3 6 3 3 3 3 2 5 3 11 5 4 11 19 21 27 8 23 4 31 28 100 33 13 14 11 8 4 5 5 0 19 23 12 5 3 4 4 7 7 30 14 4 5 8 6 3 3 5 12 2 3 3 3 2 2 3 2 2 2 2 3 2 3 4 5 7 21 12 3 2 3 5 9 9 25 31 24 11 10 7 8 4 5 6 6 8 13 8 4 4 4 3 3 2 3 2 4 4 9 9 11 27 18 5 2 2 4 2 1 4 3 2 2 3 3 3 3 3 4 6 6 17 24 7 3 3 5 2 4 4 4 3 12 21 5 3 2 4 5 6 22 22 32 16 10 15 20 6 5 5 10 4 2 2 2 2 2 2 2 3 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 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 3 2 2 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 1 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 3 5 6 5 7 30 30 26 7 6 4 5 6 5 15 69 90 27 4 3 3 2 1 2 2 2 1 2 2 2 1 2 2 2 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 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 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: 73 72 m 5H \| 28 27 m 1H \| 20 19 dd 1H J 61 78 \| 18 17 dd 1H J 52 78 \| 11 11 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)c1nc(Cl)nc2c1CCC2c1ccccc1	ir: 0 0 1 1 0 0 1 0 1 1 1 1 1 1 0 1 1 1 1 1 0 1 2 4 2 1 2 1 4 6 5 4 5 3 3 8 18 9 29 12 14 21 4 2 1 1 1 0 1 1 2 1 1 1 1 0 0 1 1 0 1 2 1 3 1 3 7 7 5 4 5 3 2 1 1 1 2 2 2 2 2 1 1 1 0 4 2 4 2 2 3 8 5 3 1 2 1 3 1 0 1 0 0 0 1 1 1 1 6 2 5 2 3 5 3 4 3 5 5 8 4 2 2 3 7 5 2 2 2 3 1 1 5 1 7 11 2 1 1 1 5 52 9 3 2 5 3 3 8 100 10 28 56 3 1 1 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 2 1 0 2 2 3 2 5 8 6 4 16 26 6 3 2 1 2 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 73 72 m 6H \| 47 46 t 1H J 50 \| 31 31 s 5H \| 30 29 ddd 1H J 75 92 187 \| 29 28 ddd 1H J 75 93 185 \| 26 24 dddd 1H J 51 75 93 145 \| 23 22 dddd 1H J 50 75 92 145	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cncc2nc(-c3ccncc3)nc(N3CCNCC3)c12	ir: 7 8 9 8 6 8 9 9 13 10 12 9 8 9 12 9 9 9 11 11 11 9 9 10 13 13 9 10 14 20 13 16 85 36 12 15 14 9 8 6 7 11 9 8 8 25 10 6 7 15 15 11 28 100 12 16 29 16 15 32 11 8 13 21 9 9 15 13 9 12 12 9 19 29 24 11 10 9 9 11 16 10 8 9 11 10 20 15 9 8 7 9 8 8 8 9 14 12 9 7 8 8 8 8 9 8 8 11 18 83 19 62 28 24 19 24 15 17 14 8 11 14 7 10 9 10 9 14 15 33 21 32 29 11 18 30 14 7 7 9 10 0 88 7 9 8 9 8 16 15 25 14 49 40 9 10 8 8 11 27 11 20 9 8 8 7 7 8 7 7 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 6 7 7 7 6 7 7 7 6 7 8 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 8 7 7 7 7 8 7 8 8 7 7 8 8 8 11 21 12 25 14 25 12 11 8 8 8 7 7 7 8 7 7 7 8 8 8 9 10 21 29 8 11 7 7 8 7 7 7 7 7 7 7 7 7 7 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 7 6 7 7 7 6 7 7 7 6 7 7 7 6 7 7; 1HNMR: 87 87 m 3H \| 83 82 d 1H J 16 \| 82 82 m 2H \| 40 40 s 2H \| 36 36 m 4H \| 29 29 m 4H \| 19 19 p 1H J 32	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=[N+]([O-])c1ccc(CS(=O)(=O)Oc2ccccc2)cc1	ir: 6 5 4 18 38 21 7 11 11 10 16 11 41 62 13 4 5 4 4 4 23 14 2 3 5 3 3 3 5 4 6 4 9 3 3 3 6 8 50 29 27 40 27 36 31 8 2 6 3 3 5 8 24 17 38 48 46 20 5 6 2 0 3 5 3 1 3 6 9 17 12 31 41 40 9 6 4 10 6 6 4 6 6 10 33 15 28 100 27 45 35 23 27 4 5 4 1 2 5 4 5 2 4 4 2 12 46 19 5 4 4 2 1 2 3 2 1 2 3 3 2 3 8 11 38 39 26 18 5 4 4 3 3 7 26 19 4 5 3 2 1 5 24 54 19 6 5 4 26 16 8 5 14 17 5 3 3 4 7 10 4 4 4 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 3 3 2 1 2 3 1 1 3 3 1 1 3 2 1 1 3 3 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 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 3 2 2 2 3 2 2 3 3 1 1 3 3 1 2 3 3 2 2 3 3 2 6 19 20 5 3 4 4 0 4 17 9 11 75 60 43 13 5 5 4 3 3 4 2 2 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 3 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 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 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 81 81 m 2H \| 78 77 dq 2H J 9 79 \| 75 75 m 2H \| 74 74 ddt 1H J 15 68 80 \| 73 72 m 2H \| 43 42 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)c1ccc2cnc(Cl)cc2c1	ir: 2 3 1 4 2 1 1 1 2 6 6 4 14 19 5 2 2 3 2 4 2 1 1 3 16 3 2 2 2 1 2 41 7 4 3 2 3 2 2 1 1 2 2 1 2 3 2 1 1 2 2 2 9 5 2 2 2 1 3 3 4 3 20 2 2 3 1 1 2 27 11 5 46 0 2 9 1 1 2 2 1 1 2 2 2 9 3 2 1 1 2 2 1 2 2 2 1 2 30 4 5 4 8 84 14 1 34 2 1 2 18 2 1 2 4 32 3 2 6 6 2 3 3 2 14 100 10 11 4 2 1 2 20 4 2 2 2 2 3 6 3 3 8 90 37 7 3 1 7 4 5 3 5 1 2 2 20 4 5 1 1 2 1 1 1 2 1 3 7 6 1 1 1 2 1 1 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 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 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 4 4 2 2 1 2 2 2 1 2 2 3 4 6 14 9 9 15 81 25 5 3 4 3 3 3 2 2 1 1 2 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 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 1 1 1 1 1 1 1 1 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; 1HNMR: 89 89 d 1H J 25 \| 85 85 t 1H J 20 \| 82 81 dd 1H J 19 87 \| 79 79 dd 1H J 16 88 \| 78 77 d 1H J 23 \| 27 26 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC1CCCCC(Cc2ccccc2)N1	ir: 3 3 3 2 2 2 3 2 1 2 2 1 1 0 0 1 1 3 5 7 3 2 1 1 1 0 0 1 1 3 5 8 5 3 1 2 2 1 3 9 26 20 4 4 9 14 6 11 19 27 14 11 5 3 3 5 2 2 2 3 3 3 1 3 2 5 5 15 17 8 9 5 6 8 5 2 1 4 2 7 8 6 4 5 4 2 1 1 2 7 2 1 1 1 1 1 2 9 13 3 10 15 29 13 4 6 4 7 9 6 4 4 12 11 10 4 7 4 5 5 4 9 7 11 13 6 4 7 2 9 6 6 5 5 11 10 6 5 3 1 0 2 8 17 5 2 3 2 2 1 1 3 1 2 1 0 0 1 0 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 0 0 0 0 0 0 0 0 0 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 1 1 1 1 1 3 2 4 3 2 1 0 2 11 3 12 15 24 16 8 2 2 2 1 1 1 1 1 0 0 2 2 1 1 1 3 9 92 100 3 2 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; 1HNMR: 73 73 m 2H \| 73 72 m 1H \| 72 72 ddt 2H J 9 15 64 \| 44 43 m 1H \| 36 35 dd 1H J 77 90 \| 33 33 d 3H J 15 \| 32 31 m 1H \| 31 30 ddt 1H J 9 66 137 \| 28 27 ddt 1H J 9 66 137 \| 17 13 m 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc3[nH]c(CO)cc3c2)cc1	ir: 3 5 7 8 4 2 5 1 3 5 4 4 5 8 6 7 19 15 6 7 1 2 3 3 1 5 4 12 12 4 3 1 3 24 9 1 1 3 5 15 3 5 2 2 4 5 6 3 2 3 4 8 11 26 19 10 5 5 2 0 2 3 3 3 4 3 5 5 4 9 2 1 1 3 1 2 3 2 6 10 10 16 5 7 10 20 34 16 4 5 7 4 5 4 3 6 6 5 3 2 3 4 9 38 5 5 8 3 4 3 0 2 3 3 2 2 2 1 2 4 3 8 5 8 9 5 3 2 5 2 2 6 5 5 4 2 2 1 1 2 3 2 2 6 3 21 5 26 14 11 15 4 5 4 5 7 9 2 10 2 2 1 1 2 7 2 1 5 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 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 2 1 0 1 1 0 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 2 2 2 1 2 2 1 1 6 5 6 10 19 62 23 22 5 4 4 4 6 21 31 6 3 2 2 2 1 0 2 3 1 1 2 3 14 100 16 12 6 10 5 4 2 2 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 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; 1HNMR: 100 100 s 1H \| 88 88 s 1H \| 77 77 t 1H J 22 \| 75 75 dd 1H J 7 161 \| 75 74 m 6H \| 72 71 d 1H J 73 \| 67 67 d 1H J 161 \| 64 63 dd 1H J 11 22 \| 46 46 dd 2H J 9 46 \| 40 40 t 1H J 47 \| 14 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C(Cl)Cc1ccc(OCCC2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cc1	ir: 14 17 9 3 3 3 3 7 5 4 4 2 2 3 4 7 2 4 4 7 4 4 2 2 2 2 24 4 1 1 1 2 1 1 1 1 3 16 5 4 8 1 1 1 3 2 2 2 2 1 2 1 7 9 23 20 6 0 4 7 4 1 3 9 9 4 10 4 3 24 7 14 3 1 2 8 4 1 1 2 2 4 10 10 3 7 5 15 100 6 3 2 5 3 2 4 2 6 15 9 2 2 3 3 1 2 2 13 6 9 9 5 3 2 8 5 8 3 8 7 6 2 3 4 6 4 2 3 7 10 5 5 3 4 7 5 3 2 2 2 1 1 1 2 8 27 7 14 38 8 4 1 5 0 0 4 1 1 0 0 0 0 2 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 1 1 1 1 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 0 0 0 1 0 0 1 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 1 1 1 1 2 2 2 2 3 7 6 1 2 4 6 2 7 25 36 9 17 39 15 7 5 3 3 3 2 5 22 1 1 0 1 1 0 0 1 0 0 0 0 0 0 1 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; 1HNMR: 72 71 dt 2H J 9 88 \| 68 68 m 2H \| 48 48 s 1H \| 46 45 t 1H J 73 \| 43 41 m 3H \| 41 40 dt 1H J 68 119 \| 34 33 ddt 1H J 8 74 131 \| 31 31 ddt 1H J 9 75 130 \| 28 27 ddd 1H J 50 77 156 \| 27 26 ddd 1H J 50 77 156 \| 23 22 dt 1H J 68 145 \| 22 21 m 9H \| 21 20 m 2H \| 18 17 ddd 1H J 50 77 137 \| 14 13 s 2H \| 13 12 t 3H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)[S@@](=O)/N=C/c1ccc(OCc2ccccc2F)nc1	ir: 2 1 1 3 2 1 3 2 4 3 1 1 0 1 2 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 8 9 7 3 2 2 7 16 25 5 2 2 2 1 1 1 1 5 9 9 15 6 4 1 1 1 1 4 1 1 1 1 8 18 5 7 7 2 1 2 5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 6 3 2 6 2 1 1 0 1 1 1 1 4 6 5 1 1 3 2 3 19 3 2 3 2 1 1 1 1 0 1 5 2 2 7 17 7 1 2 2 3 2 1 2 1 2 5 14 55 8 3 0 4 7 2 1 1 2 3 11 5 8 1 1 2 5 2 1 1 3 2 1 2 100 8 1 2 1 0 1 1 1 0 0 1 0 0 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 3 1 0 1 1 1 1 0 1 1 2 2 7 7 3 19 45 15 8 2 2 1 1 1 1 1 0 1 0 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 96 96 s 1H \| 87 86 d 1H J 18 \| 82 81 dd 1H J 20 80 \| 75 74 dddt 1H J 8 17 36 87 \| 73 72 dddd 1H J 18 40 79 88 \| 72 70 m 3H \| 53 53 dd 2H J 8 36 \| 13 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1cc(F)c2cnc(NCCCF)nc2c1	ir: 2 6 7 9 11 5 2 2 4 9 5 14 16 12 7 6 15 14 10 15 34 51 36 25 22 4 5 15 29 53 47 13 6 6 4 1 1 2 1 1 1 2 2 2 3 2 21 22 7 3 2 2 1 1 1 1 2 5 7 5 2 1 1 2 1 2 8 22 31 10 13 5 5 5 3 1 6 11 20 5 1 1 2 2 1 2 3 6 7 3 1 1 2 1 2 3 2 3 2 1 2 2 15 2 1 3 4 6 21 15 9 5 0 2 6 31 14 2 2 2 0 7 5 2 5 2 1 1 4 2 4 26 16 5 3 2 2 6 16 26 13 9 3 7 28 26 48 100 16 3 39 24 3 2 3 2 1 1 1 4 15 2 1 1 2 6 40 3 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 0 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 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 2 1 1 2 1 2 1 1 1 1 2 2 2 2 6 6 3 11 10 6 3 2 2 1 2 2 16 21 6 3 3 2 1 1 2 2 4 3 2 3 10 48 59 63 60 10 3 2 2 2 4 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; 1HNMR: 95 94 d 1H J 51 \| 83 82 d 1H J 21 \| 79 79 dd 1H J 22 121 \| 56 56 t 1H J 57 \| 45 44 t 1H J 42 \| 44 43 t 1H J 43 \| 36 35 tdd 2H J 35 56 79 \| 21 20 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Cn2cc(N)cc(Cl)c2=O)cc1	ir: 12 12 16 16 15 19 15 9 12 8 9 8 7 9 6 8 7 12 7 7 7 8 8 10 7 15 8 8 6 7 7 6 7 6 7 8 11 8 11 7 6 7 9 4 8 21 21 18 17 13 15 10 18 16 11 28 36 7 8 11 9 11 7 9 14 16 10 5 7 18 6 6 6 10 16 7 6 6 5 5 6 7 50 10 6 6 13 17 9 9 8 11 23 12 8 8 12 7 7 7 8 6 5 5 8 13 16 9 8 7 5 8 12 7 5 6 7 7 5 8 7 6 7 7 10 13 14 10 10 7 7 7 7 7 7 7 10 13 9 6 6 5 5 6 6 5 9 27 15 19 12 8 14 9 13 14 79 53 9 8 6 6 6 6 74 5 6 7 5 4 5 6 5 4 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 6 7 6 5 6 6 5 5 6 6 5 5 6 6 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 6 6 6 6 5 6 8 9 13 8 9 32 49 34 25 17 15 10 6 8 6 6 6 6 6 6 5 6 6 5 16 23 7 5 4 6 7 4 4 9 9 0 100 72 2 11 8 3 4 7 6 4 5 7 6 4 5 7 6 4 5 7 6 4 6 6 5 4 6 6 5 4 5 6 5 4 7 8 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 6 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6; 1HNMR: 73 72 dt 2H J 9 86 \| 68 68 m 3H \| 67 67 d 1H J 13 \| 64 64 s 2H \| 51 51 q 2H J 9 \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)[C@H](C)NC(=O)c1noc(-c2ccc(C(F)(F)F)cc2)c1CO	ir: 3 2 1 3 3 5 1 4 2 4 2 3 2 2 2 7 8 4 2 5 6 4 5 13 6 9 10 9 11 13 12 8 26 29 14 8 8 5 2 3 3 2 1 2 2 1 4 4 9 20 2 4 3 4 5 23 10 8 5 2 2 1 2 3 2 1 1 4 3 6 4 3 2 1 1 1 1 2 1 2 2 2 1 3 2 5 3 7 7 6 3 3 6 6 12 33 12 31 19 62 8 4 3 3 5 3 3 3 1 3 3 4 41 13 1 2 6 8 3 4 2 4 6 7 11 5 2 9 5 3 2 3 2 2 1 3 3 2 2 44 19 2 3 12 11 7 2 3 8 13 19 6 4 2 1 3 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 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 2 1 2 2 4 3 2 8 4 19 12 11 11 11 19 100 0 15 9 8 1 2 2 1 0 2 2 2 1 3 4 2 12 16 16 9 4 4 4 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; 1HNMR: 78 77 m 4H \| 75 74 d 1H J 95 \| 49 48 d 2H J 62 \| 42 42 m 1H \| 37 36 ddddd 1H J 25 42 51 80 112 \| 20 18 m 1H \| 12 12 dd 3H J 15 64 \| 9 9 dd 3H J 15 68 \| 9 8 dd 3H J 15 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCNC(=O)NS(=O)(=O)c1ccccc1-c1ccno1	ir: 4 3 1 2 7 5 1 10 3 6 5 3 3 4 4 9 4 6 2 3 2 3 6 20 6 1 1 1 2 1 2 2 2 2 7 6 15 24 12 6 5 5 33 10 2 4 2 11 4 4 8 6 2 1 2 3 2 1 1 3 1 1 1 2 5 5 5 3 1 1 1 2 1 2 2 2 1 1 2 4 2 12 7 4 4 73 16 1 1 2 1 1 1 1 1 1 1 1 1 6 15 1 2 1 6 6 2 1 1 3 6 3 2 2 2 1 1 2 3 2 2 3 2 2 5 1 2 1 1 2 3 18 3 3 6 10 8 6 7 4 6 6 3 3 3 3 8 32 100 39 29 2 3 3 2 0 1 2 1 0 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 1 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 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 2 1 1 1 1 2 1 2 4 3 4 6 16 9 8 5 3 4 1 1 1 1 1 1 1 1 1 1 4 2 1 6 11 2 5 11 27 11 13 6 13 4 2 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 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 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 83 82 d 1H J 16 \| 79 79 dd 1H J 14 84 \| 79 78 dd 1H J 13 91 \| 77 76 ddd 1H J 13 76 86 \| 75 75 ddd 1H J 14 76 90 \| 74 73 s 1H \| 70 69 d 1H J 16 \| 55 54 t 1H J 45 \| 28 27 td 2H J 45 59 \| 14 13 m 4H \| 10 9 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cc(C(=O)O)cc(-c2ccc(F)cc2)c1	ir: 6 4 2 2 2 1 4 1 0 0 0 4 7 4 1 2 4 6 2 3 6 37 89 11 2 2 0 2 2 1 1 7 13 3 0 0 0 0 1 0 0 0 0 0 1 0 0 0 1 1 0 0 0 1 6 8 11 2 1 0 1 2 0 1 2 0 0 6 23 4 0 1 1 0 11 2 1 5 42 1 1 1 0 0 1 6 0 4 6 2 1 1 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 0 2 6 5 4 2 1 1 10 1 4 6 2 4 3 1 6 9 4 2 10 3 1 0 1 0 0 0 1 0 0 1 1 2 17 48 100 4 1 2 2 2 2 0 5 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 4 3 14 28 12 4 3 1 1 0 0 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 87 t 1H J 22 \| 84 83 p 2H J 22 \| 75 74 m 2H \| 72 71 m 2H \| 39 39 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1cccc(Cl)c1S(N)(=O)=O	ir: 5 9 12 4 4 4 5 4 5 4 10 8 6 11 3 7 6 10 10 10 8 6 5 4 5 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 3 4 4 4 16 12 5 4 4 4 4 4 4 4 4 4 4 4 3 4 5 4 5 4 5 4 5 5 7 6 4 5 5 5 5 5 4 6 12 13 16 14 28 9 13 20 8 10 4 6 9 8 5 4 4 5 4 4 5 4 6 8 5 4 4 4 4 4 12 4 4 4 7 13 25 19 25 8 5 4 5 4 4 4 4 4 4 4 4 4 4 3 4 4 3 5 5 6 4 4 4 4 4 7 4 4 3 4 4 4 4 5 15 9 5 4 6 36 12 5 6 4 4 4 3 4 4 4 3 4 4 3 3 3 4 4 4 4 4 3 3 4 3 4 3 4 4 4 4 4 4 3 3 3 4 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 4 3 4 3 3 3 4 3 3 3 3 3 3 3 4 4 3 4 4 4 3 4 4 4 3 4 4 4 4 4 4 4 4 4 5 4 7 5 9 12 12 4 4 4 3 4 4 3 3 4 5 3 3 5 6 0 100 35 12 7 5 4 21 34 6 3 12 14 25 22 9 4 3 4 4 4 3 3 3 4 4 3 3 4 4 3 3 4 3 4 4 4 4 3 4 4 3 3 3 4 3 3 3 4 4 3 3 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 3 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; 1HNMR: 73 73 m 2H \| 70 70 s 2H \| 70 69 dd 1H J 24 68 \| 69 69 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1ccccc1Nc1nc(Cl)ncc1Cl	ir: 1 2 1 1 3 3 2 5 2 5 3 2 2 4 10 8 4 7 13 9 7 48 24 13 8 8 2 4 7 3 4 5 5 2 3 5 23 15 8 5 9 6 17 35 100 38 21 9 2 6 2 1 2 3 4 1 2 2 1 1 5 2 1 1 1 2 1 1 2 4 3 4 3 3 5 33 3 3 5 32 8 4 4 3 2 5 3 4 2 3 1 1 1 1 0 1 1 1 0 1 16 2 10 2 2 1 1 1 1 1 1 1 50 5 6 3 2 2 1 2 4 5 2 2 2 2 43 5 1 1 1 2 2 2 2 6 6 6 2 0 4 14 5 10 63 46 8 4 4 4 5 8 7 8 44 23 10 61 55 7 2 3 10 37 5 2 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 1 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 1 1 1 1 1 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 6 5 44 13 1 3 3 2 0 2 3 8 40 3 1 1 1 3 2 3 6 4 3 4 4 19 80 28 9 10 4 5 4 1 2 2 1 1 1 2 1 1 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 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 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 96 95 s 1H \| 85 85 s 1H \| 84 83 dd 1H J 14 79 \| 80 79 dd 1H J 16 79 \| 77 76 td 1H J 15 79 \| 67 67 td 1H J 14 80	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(CCl)c1cccc2ccccc12	ir: 1 2 3 3 3 4 9 3 1 4 5 6 4 11 6 4 3 5 7 3 3 4 6 2 3 5 3 2 1 4 4 11 2 4 5 0 1 5 4 0 2 6 7 1 4 44 42 12 3 3 5 4 2 1 2 2 2 1 2 2 2 2 2 1 2 2 2 2 3 6 2 2 2 3 5 5 3 3 2 2 4 5 2 2 4 6 1 3 4 5 3 2 3 9 14 4 3 4 6 2 2 2 2 4 9 5 7 3 4 5 4 4 4 4 7 3 3 2 4 4 7 11 20 6 7 4 2 3 4 3 3 3 4 3 1 8 33 14 9 4 8 17 22 6 2 6 4 12 11 10 6 38 23 3 2 3 2 7 7 5 4 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 2 1 2 2 2 2 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 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 3 1 2 4 3 2 3 5 4 6 14 17 27 100 42 27 8 5 3 2 3 2 2 2 2 2 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 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 2 2; 1HNMR: 80 79 m 4H \| 76 75 m 3H \| 49 48 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Clc1ccc2c3c1c1c(n3CCNCC2)CCC1	ir: 1 1 1 1 1 1 1 1 1 1 2 1 2 11 9 6 5 4 2 3 4 3 2 1 1 1 1 1 1 1 2 2 1 2 4 12 13 14 9 18 19 10 23 10 9 8 9 13 18 8 11 8 7 18 14 11 3 5 6 3 3 4 2 10 7 2 2 5 9 9 6 1 1 2 1 3 2 2 2 1 0 1 1 1 2 1 1 3 3 3 0 1 2 3 2 2 6 2 1 7 8 2 1 4 3 1 1 1 1 2 5 13 31 43 27 13 12 18 14 13 10 14 17 4 11 9 28 28 9 10 3 4 4 3 9 5 5 3 3 1 3 6 2 2 2 2 11 14 3 1 1 1 1 0 6 5 1 0 0 2 4 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 1 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 0 0 0 0 0 0 1 0 0 0 1 1 0 0 1 1 1 1 3 2 1 4 4 4 2 3 4 4 6 25 15 14 23 15 4 6 5 3 5 1 1 1 3 3 1 2 3 2 1 5 13 21 100 72 12 6 4 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 0 0 0 0 0 0 0 0; 1HNMR: 73 72 d 1H J 79 \| 71 70 dt 1H J 9 79 \| 39 39 t 2H J 34 \| 30 30 m 4H \| 29 29 t 2H J 51 \| 29 26 m 5H \| 22 22 p 2H J 52	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCCC12C=CC(C1)C1C(=O)OC(=O)C12	ir: 23 19 8 3 12 20 6 3 1 3 4 3 5 12 19 9 2 4 8 3 3 5 6 10 14 8 9 6 3 8 11 4 3 4 4 2 2 6 5 1 2 5 8 5 6 5 3 1 15 9 3 1 2 5 2 0 3 5 3 2 8 5 4 1 4 7 5 3 9 6 5 9 19 13 8 1 5 3 2 1 3 7 2 7 6 4 2 2 4 3 3 3 10 8 3 3 10 7 3 10 6 3 2 3 3 8 30 9 16 23 15 8 13 4 1 4 5 3 4 7 22 12 3 6 6 6 9 16 5 4 2 9 5 2 2 6 10 4 2 7 6 2 1 10 24 100 18 7 3 3 5 6 10 4 4 3 3 3 3 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 3 3 2 1 3 3 2 2 3 3 1 2 3 3 1 2 3 2 1 2 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 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 1 2 4 3 2 2 4 3 2 2 4 3 2 5 9 5 4 20 19 9 8 14 25 44 15 5 3 5 5 4 4 4 4 3 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 2 2 2 3 2 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 2 2 3 2 2 2 3 2 2 2 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 61 60 m 2H \| 58 56 m 1H \| 51 50 ddt 1H J 13 24 159 \| 50 49 m 1H \| 36 35 m 1H \| 35 34 dd 1H J 18 64 \| 32 31 ddd 1H J 17 64 71 \| 22 21 m 2H \| 21 19 dtdt 1H J 14 69 84 113 \| 19 18 ddt 1H J 9 38 115 \| 18 17 dtt 1H J 9 85 126 \| 16 15 dtt 1H J 9 86 126	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(N)(CF)C1	ir: 3 2 2 2 13 10 2 3 3 3 26 6 3 6 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 2 1 1 1 1 1 1 2 1 1 1 1 1 2 1 1 1 3 1 1 2 2 13 6 1 3 3 12 26 100 16 18 27 11 17 7 2 3 1 7 8 9 2 1 1 1 1 1 1 1 1 1 1 2 3 1 3 3 2 1 1 2 2 2 1 1 1 1 1 1 3 5 2 2 1 1 1 1 2 1 6 7 2 7 20 3 2 7 5 0 5 10 7 9 5 3 4 10 16 15 13 23 44 23 9 5 2 1 1 1 1 1 1 1 1 1 1 1 1 3 30 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 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 0 0 1 1 1 1 1 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 2 2 3 1 1 1 2 1 2 6 21 2 1 1 1 1 1 1 1 0 1 2 1 1 1 5 10 17 34 26 5 1 5 4 1 52 67 1 5 3 0 0 2 1 0 0 1 1 0 1 2 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 0 1 1 0 0 1 1 0 0 1 1 0 0 1; 1HNMR: 44 44 d 0H J 113 \| 44 43 d 0H J 113 \| 42 41 d 0H J 114 \| 41 40 d 0H J 114 \| 36 35 m 2H \| 34 33 m 2H \| 29 28 d 2H J 33 \| 20 19 dtd 1H J 20 37 134 \| 18 17 m 1H \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN1CCC(c2c[nH]c3ccc(NC(=O)Nc4ccccc4)nc23)CC1	ir: 0 1 2 1 1 1 1 2 16 3 2 4 0 2 1 1 1 3 5 16 5 2 13 5 3 4 11 5 16 10 2 3 2 2 2 4 9 7 4 12 10 6 25 49 48 21 8 2 4 4 2 1 1 12 26 5 1 0 1 0 1 2 2 0 2 2 1 4 4 1 1 1 1 1 4 1 1 3 2 5 11 6 2 2 1 1 1 1 2 2 5 5 3 2 4 19 1 7 4 2 4 2 2 3 36 7 7 7 48 4 2 3 10 1 2 3 2 1 1 1 1 1 1 1 2 1 1 1 3 1 1 2 2 2 5 6 4 1 1 2 4 6 32 3 3 6 1 2 2 7 12 100 9 28 8 6 38 1 1 4 9 16 5 1 2 1 1 0 1 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 0 0 0 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 1 0 1 1 0 1 1 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 2 2 5 3 16 56 10 5 6 3 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 2 3 3 7 25 96 16 19 1 2 2 0 1 1 1 0 0 1 1 0 1 1 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1; 1HNMR: 98 98 s 1H \| 91 90 s 1H \| 79 78 d 1H J 71 \| 78 77 d 1H J 86 \| 74 73 m 3H \| 73 72 m 2H \| 70 70 tt 1H J 11 68 \| 30 29 m 4H \| 26 26 ddd 2H J 58 86 119 \| 24 23 s 2H \| 23 22 ddt 2H J 59 86 124 \| 20 19 ddt 2H J 58 84 124	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1cnoc1-c1ccc(OC)c(OC)c1	ir: 5 4 4 4 3 4 5 4 4 9 9 6 4 4 5 5 5 4 4 3 4 6 6 5 5 5 7 23 19 91 32 6 6 5 8 6 19 6 5 9 17 4 3 3 3 2 3 4 4 2 3 5 4 21 37 35 3 6 4 3 4 2 13 14 8 8 8 10 15 18 6 3 5 6 14 6 15 19 7 8 4 3 4 21 4 3 3 4 6 7 5 4 7 5 6 3 3 3 3 7 7 3 3 4 3 3 0 46 3 3 3 4 3 7 8 4 6 7 7 6 6 6 3 19 32 9 6 9 16 17 29 15 7 4 3 3 3 3 3 5 4 4 6 49 11 4 4 4 42 38 5 13 22 8 10 18 27 100 17 3 3 3 4 3 3 3 3 2 2 2 2 2 2 3 2 3 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 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 3 3 4 3 4 3 3 3 4 3 3 5 3 3 6 22 31 19 21 43 95 11 6 4 3 5 3 3 3 3 2 2 3 3 2 2 3 3 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; 1HNMR: 87 86 s 1H \| 75 75 dd 1H J 16 82 \| 74 73 d 1H J 17 \| 70 70 d 1H J 81 \| 43 43 q 2H J 64 \| 39 38 d 6H J 25 \| 14 14 t 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(CNCCC(C)C)ccc1Oc1cnc(C(N)=O)cn1	ir: 1 1 1 1 2 2 11 13 6 3 3 2 2 4 3 10 10 30 23 5 6 8 4 12 5 2 2 1 3 2 5 10 22 13 7 1 3 4 4 5 4 11 7 7 11 4 9 3 1 3 1 2 3 10 10 10 2 2 2 1 1 2 2 0 7 10 6 10 6 14 35 9 5 8 4 1 3 2 2 2 2 2 3 3 2 2 3 1 2 3 2 3 2 3 3 5 2 5 11 6 3 2 3 2 2 4 5 3 2 15 13 5 10 5 1 3 2 3 2 2 1 2 3 3 2 2 2 2 2 5 19 5 6 2 2 2 2 6 3 2 1 1 2 4 1 1 1 1 1 2 5 2 2 5 2 2 3 16 10 10 5 0 2 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 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 1 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 2 5 2 7 12 4 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 5 9 10 22 10 3 2 1 1 1 0 2 3 13 100 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 0 1 1 1 0 1 1; 1HNMR: 88 88 s 1H \| 80 80 s 1H \| 73 73 s 2H \| 69 69 d 1H J 86 \| 69 68 m 2H \| 49 48 p 1H J 52 \| 39 39 d 1H J 9 \| 39 39 s 4H \| 29 28 td 2H J 51 59 \| 16 15 m 3H \| 9 8 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)Oc1ccccc1C(=O)Nc1cccc(S(C)(=O)=O)c1	ir: 1 2 2 2 1 4 3 3 1 3 34 9 2 2 2 2 1 1 1 1 2 3 2 1 1 2 2 4 4 9 20 13 7 4 4 4 6 6 4 5 9 100 83 6 4 13 12 22 28 16 4 1 2 4 2 0 2 3 3 0 2 3 1 0 7 17 11 6 5 7 3 1 1 2 2 1 2 6 5 1 5 6 2 4 3 5 24 11 16 4 1 1 2 3 1 1 1 2 2 2 2 2 4 8 7 13 15 4 2 2 2 2 2 1 1 2 2 2 2 3 6 10 7 5 8 10 5 4 2 2 1 1 1 1 1 2 4 18 4 3 7 11 4 9 9 21 71 7 5 4 3 4 42 8 7 4 11 3 1 3 2 6 5 6 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 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 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 2 5 4 1 1 1 1 1 1 1 1 2 3 5 4 9 9 6 10 87 36 9 2 1 1 2 1 2 2 2 1 1 1 1 1 1 1 2 1 1 3 4 8 10 20 16 8 3 4 2 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 2 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 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 1 0 1 1; 1HNMR: 79 78 m 2H \| 77 76 dddd 3H J 11 20 46 79 \| 76 76 m 1H \| 75 75 t 1H J 80 \| 74 74 td 1H J 12 78 \| 73 73 dd 1H J 13 82 \| 32 32 s 3H \| 23 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN1CCC(c2ccncc2N)CC1	ir: 10 12 50 23 24 9 6 4 2 5 6 17 8 2 3 2 2 2 5 71 13 10 5 1 2 3 2 2 2 1 3 2 2 3 7 5 3 2 2 3 1 2 2 2 5 5 2 3 2 1 2 2 1 2 3 4 2 1 1 2 1 1 2 2 1 0 2 4 4 2 3 4 5 4 11 6 3 3 16 18 17 22 2 2 1 1 2 3 7 11 14 7 2 2 3 2 2 5 4 3 1 2 2 2 3 2 2 2 1 1 1 7 4 2 3 1 1 2 4 5 2 2 1 1 1 1 3 1 1 1 2 1 1 1 3 2 0 1 1 1 0 1 1 1 1 6 4 1 28 6 5 16 45 19 14 3 11 76 41 5 4 7 13 2 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 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 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 1 0 1 1 0 0 1 1 0 1 1 1 1 1 1 2 2 1 2 2 1 2 2 7 2 3 3 3 1 1 1 1 1 1 2 1 0 1 1 1 0 1 2 1 3 77 7 2 2 1 1 1 1 3 4 7 15 100 7 9 4 0 1 1 1 0 1 1 1 0 0 1 0 0 0 0 0 1 1 0 1 1 0 0 0 1 1 1 1 1 1 1 2 1 1 1 1 1 0 0 1 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; 1HNMR: 83 83 dd 1H J 14 50 \| 81 80 d 1H J 13 \| 71 70 m 1H \| 45 45 s 2H \| 30 29 m 3H \| 26 26 ddd 2H J 58 85 119 \| 24 23 s 2H \| 22 21 ddt 2H J 58 86 125 \| 19 18 ddt 2H J 58 84 125	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(c1ccccc1)N1CCCC1	ir: 0 6 11 5 0 7 12 4 0 6 9 4 1 6 9 4 2 7 9 4 2 7 9 3 2 10 10 8 6 10 12 9 21 31 100 49 56 17 8 6 8 26 48 26 9 11 7 1 5 10 7 1 6 11 6 1 8 15 7 0 8 14 6 2 8 10 4 3 15 14 9 2 7 9 5 1 8 15 8 3 8 9 6 6 8 8 2 4 9 7 5 12 11 9 3 5 9 8 2 4 10 6 2 4 10 9 4 12 15 9 4 16 25 17 3 20 20 8 2 13 15 13 7 11 13 6 3 8 11 11 20 50 78 20 19 48 9 5 4 8 11 10 91 62 100 10 24 79 24 11 4 12 14 8 6 9 6 1 4 11 11 2 4 9 6 1 5 9 5 0 5 9 5 0 5 9 5 1 5 9 4 1 6 8 4 1 6 8 4 2 6 8 3 2 7 7 3 3 7 7 3 3 8 7 2 3 8 6 2 3 8 6 2 4 8 6 1 4 8 6 1 4 9 5 1 5 9 5 1 5 9 5 1 5 9 5 1 5 8 4 2 6 8 4 2 6 8 4 2 6 7 3 3 7 7 3 3 7 7 3 3 7 7 3 3 7 6 2 4 8 6 2 5 9 7 8 7 9 7 2 7 12 8 8 54 34 33 79 89 48 15 3 9 13 7 5 7 8 4 2 6 8 4 2 6 7 4 3 7 7 3 3 7 7 3 3 7 6 3 3 7 6 3 4 7 6 2 4 7 6 2 4 8 5 2 4 8 5 2 5 8 5 1 5 8 5 2 5 8 4 2 5 8 4 2 6 7 4 2 6 7 4 3 6 7 4 3 6 7 3 3 6 6 3 4 7 6 3 4 7 6 3 4 7 6 2 4 7 5 2 4 7 5 2 5 8 5 2 5 8; 1HNMR: 75 74 m 5H \| 36 35 m 4H \| 20 19 p 4H J 19	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
c1ccc(CNCCc2ncccn2)cc1	ir: 5 4 2 2 1 1 1 1 1 2 1 1 1 1 1 4 3 1 1 2 2 3 2 5 21 24 8 6 2 4 17 4 2 2 2 5 2 2 4 10 19 6 6 17 23 17 30 10 6 7 7 11 33 31 14 5 11 8 4 1 2 3 2 3 21 15 9 24 8 14 2 0 3 4 7 8 4 13 6 2 2 2 1 1 2 2 1 1 2 3 10 3 2 3 2 2 3 17 8 2 3 2 1 2 2 4 16 13 17 6 1 13 70 7 9 2 3 8 4 3 3 8 5 5 16 4 2 2 1 3 8 4 3 4 6 22 46 25 2 6 6 14 18 97 5 7 5 3 2 2 3 7 17 37 71 13 9 4 2 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 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 2 1 1 1 1 2 2 2 1 1 2 2 4 3 3 2 2 1 3 3 3 1 13 5 10 46 64 5 3 4 2 1 2 2 2 1 2 2 2 2 3 3 6 9 70 100 10 5 3 3 2 1 1 1 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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: 87 86 d 2H J 40 \| 74 72 m 6H \| 39 38 dt 2H J 9 54 \| 33 32 ddt 1H J 54 62 73 \| 32 31 dt 2H J 52 68 \| 28 28 t 2H J 51	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc(N2CCNCC2)nc2[nH]c(-c3c(NC[C@@H](O)c4cccc(Cl)c4)cc[nH]c3=O)nc12	ir: 8 3 4 5 6 9 6 10 6 29 12 5 3 7 3 9 6 6 8 4 7 12 12 3 60 20 4 29 17 39 32 42 32 1 3 4 4 2 3 4 5 51 100 8 62 34 10 23 29 16 18 19 9 38 20 60 17 12 3 1 2 4 7 11 12 35 7 7 15 6 11 3 4 6 2 1 3 8 5 6 18 4 5 4 5 23 4 25 44 14 25 37 11 4 4 1 3 4 12 3 1 2 7 3 12 5 8 6 11 46 43 17 16 20 9 20 6 7 8 3 19 27 10 7 4 11 17 32 12 23 15 5 3 2 4 6 6 13 3 12 19 9 11 3 4 7 34 4 2 10 7 15 31 11 45 38 17 25 15 44 70 11 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 0 1 0 1 0 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 0 0 1 1 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 1 0 1 0 1 1 0 1 1 1 1 1 0 1 0 0 0 1 1 0 1 0 0 0 1 1 1 0 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 2 2 1 2 3 2 1 1 2 2 3 4 9 6 7 13 28 17 9 10 3 7 6 26 9 56 23 1 3 3 2 5 8 12 14 100 10 5 15 37 21 25 30 12 6 2 2 1 0 1 2 1 0 1 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 0 1 0 0 0 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; 1HNMR: 92 91 t 1H J 64 \| 75 74 t 1H J 65 \| 74 73 m 4H \| 67 67 d 1H J 66 \| 46 45 q 1H J 48 \| 43 43 d 1H J 53 \| 38 37 m 6H \| 35 35 ddd 1H J 47 65 130 \| 28 28 s 3H \| 27 27 td 4H J 32 48 \| 22 21 p 1H J 33	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)Nc1cc(CN)cc(C(C)C)c1	ir: 9 5 6 2 4 3 2 2 0 1 2 1 1 1 2 1 1 2 2 1 2 2 3 1 4 6 5 9 12 13 20 48 26 15 18 7 5 3 2 1 1 1 1 0 2 1 1 0 1 5 2 1 2 2 2 4 4 11 41 19 44 13 6 1 4 4 17 23 19 9 41 30 12 6 5 6 5 3 2 3 4 3 2 1 1 2 1 1 1 1 2 3 1 4 6 3 5 4 2 1 2 2 5 5 12 7 4 2 2 1 0 1 0 1 1 2 4 3 6 10 15 4 7 6 13 11 7 4 9 6 10 20 24 7 19 12 5 10 5 7 4 1 3 5 22 100 8 6 10 10 5 2 5 2 1 1 1 0 0 3 7 4 89 3 1 1 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 1 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 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 1 0 0 0 0 0 0 1 0 0 1 1 1 0 0 0 0 0 0 1 2 1 1 2 2 3 3 5 22 22 10 3 3 1 1 1 3 1 2 2 4 6 8 16 28 24 22 19 8 8 14 40 22 34 37 29 20 5 2 1 0 0 1 1 0 0 1 0 0 0 1 1 0 1 1 1 1 1 1 0 0 0 1 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; 1HNMR: 86 85 s 1H \| 74 74 tt 1H J 9 21 \| 73 73 td 1H J 10 22 \| 71 70 tq 1H J 8 20 \| 40 39 tt 2H J 9 63 \| 30 30 s 2H \| 30 29 m 1H \| 17 16 t 2H J 62 \| 13 12 d 6H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)CCOC(=O)/C(=N\O)c1csc(N)n1	ir: 21 12 22 38 23 30 69 28 37 28 17 21 20 10 11 8 7 10 10 8 12 12 10 5 8 8 11 6 7 7 7 5 10 8 8 3 2 6 7 3 5 10 5 8 8 12 7 10 8 11 6 1 5 9 5 0 7 15 7 2 6 9 4 3 6 8 6 4 15 42 26 12 9 9 19 5 7 10 5 6 8 7 3 5 14 14 32 40 14 23 19 17 7 7 4 5 10 11 5 14 15 38 8 9 20 25 9 14 11 6 2 3 7 5 3 5 9 6 3 11 13 8 5 7 8 4 0 7 9 6 13 23 14 5 6 7 7 3 1 5 6 2 2 6 8 2 2 13 24 44 17 37 18 15 12 8 5 4 3 4 5 4 4 5 4 2 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 4 5 2 1 4 5 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 1 2 5 4 1 2 5 4 1 3 5 3 1 3 5 3 1 3 5 3 0 3 5 3 1 3 5 3 1 4 5 3 1 4 5 3 2 4 5 3 2 4 5 2 2 4 4 2 2 4 4 2 2 5 4 2 2 4 4 2 3 10 9 4 5 8 7 4 5 8 5 2 4 9 8 11 24 9 13 4 6 10 5 4 6 10 12 64 100 5 4 4 5 6 3 3 10 20 61 28 13 6 5 3 5 6 4 9 51 45 36 9 9 5 3 5 6 5 3 5 8 9 6 4 6 4 3 3 5 4 2 3 5 3 2 3 5 3 1 3 5 3 2 3 4 3 1 3 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 2 2 4 3 2 3 4 3 2 3 4 3 1 3 4 3 1 3 5; 1HNMR: 70 70 s 1H \| 66 66 s 2H \| 47 46 t 3H J 82 \| 35 34 t 3H J 83 \| 31 30 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)Cc1ccc(OCC(C)NCC(O)c2cccc(Cl)c2)cc1	ir: 7 4 9 4 14 5 4 6 3 6 14 13 4 5 6 3 3 10 2 2 1 1 1 2 2 5 2 1 3 2 4 10 1 3 2 4 2 2 4 3 4 5 20 9 2 4 27 21 5 3 6 6 8 13 35 76 9 30 8 4 5 2 2 3 7 13 6 5 14 20 3 1 2 4 6 4 9 10 3 2 3 4 2 3 8 22 22 16 25 41 36 2 3 2 3 10 6 4 5 6 1 9 9 2 11 5 4 9 3 3 4 3 9 17 8 5 9 13 16 13 10 29 10 5 3 4 12 19 4 5 2 4 6 2 2 14 2 3 1 2 35 11 6 9 69 7 5 8 33 9 2 7 11 1 9 1 1 1 1 3 2 1 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 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 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 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 2 1 3 4 1 2 3 3 3 7 12 7 69 100 14 6 7 2 2 3 2 2 3 1 1 1 2 0 3 2 3 2 7 77 35 5 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 4H \| 72 72 dt 2H J 9 87 \| 69 68 m 2H \| 58 57 d 1H J 51 \| 48 47 td 1H J 41 49 \| 41 40 dd 1H J 38 119 \| 39 37 m 2H \| 37 36 s 2H \| 36 36 t 2H J 9 \| 32 31 dqt 1H J 38 59 78 \| 30 29 ddd 1H J 45 65 134 \| 28 27 ddd 1H J 45 65 134 \| 12 11 d 3H J 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N/N=c1\[nH]c(Cl)nc2c1ncn2C1CCCCO1	ir: 1 6 15 9 2 2 4 5 11 9 3 2 3 3 3 4 3 4 6 10 17 12 4 5 2 4 6 5 4 14 7 2 6 16 7 3 3 3 3 2 3 4 5 5 14 3 46 50 36 6 3 2 9 12 4 1 2 3 2 2 3 3 3 3 6 3 1 1 1 3 2 1 3 2 1 1 2 3 5 1 2 2 1 3 4 2 3 1 2 3 3 3 11 10 1 1 2 3 2 2 13 11 2 3 2 1 0 2 2 9 24 4 3 5 5 4 4 4 3 4 3 1 1 3 2 2 2 6 6 9 6 51 61 0 0 2 2 1 1 2 2 1 2 4 6 16 4 2 2 1 1 4 5 3 5 3 5 14 12 3 1 1 2 9 9 1 2 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 2 2 1 0 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 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 2 1 2 2 1 1 2 2 2 2 5 4 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 3 2 2 15 3 2 2 3 2 3 23 24 6 74 100 17 6 11 2 1 2 2 0 1 3 2 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 1 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 0 1 2 1 0 1 2 1 0 1 2; 1HNMR: 83 83 s 1H \| 62 62 s 2H \| 60 59 m 1H \| 39 38 m 1H \| 37 37 m 1H \| 24 23 m 1H \| 21 20 m 1H \| 19 18 m 1H \| 18 16 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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