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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
Nc1ncnc2c1c(-c1cnc3ccccc3c1)c1n2CC[C@@H](N)CC1	ir: 8 5 3 2 3 2 2 1 3 1 2 1 2 2 2 2 1 3 7 2 2 1 3 2 2 1 6 1 2 1 1 1 1 1 2 1 2 3 7 15 20 2 6 17 3 1 2 3 9 1 3 8 2 2 1 1 21 3 7 3 2 1 1 3 4 0 1 1 1 3 2 11 2 5 1 4 10 1 1 1 1 1 2 14 2 1 1 1 3 0 1 3 2 1 2 2 2 4 5 2 2 1 1 2 1 2 2 5 2 1 1 1 1 1 1 2 3 2 3 3 2 3 3 5 1 1 5 3 8 7 5 1 2 10 6 3 36 4 1 1 1 1 1 1 4 2 4 8 4 3 2 11 100 9 11 2 7 78 10 9 1 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 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 1 1 0 0 1 1 0 0 1 1 0 2 2 1 2 1 1 1 0 1 1 4 1 8 15 15 4 1 1 1 0 1 1 0 0 1 3 2 9 10 7 3 18 6 3 3 11 19 1 1 1 0 1 1 2 81 3 1 1 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 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; 1HNMR: 89 88 d 1H J 18 \| 85 84 t 1H J 19 \| 82 81 s 1H \| 80 80 dd 1H J 14 77 \| 80 79 m 1H \| 78 77 td 1H J 11 75 \| 76 75 td 1H J 16 84 \| 65 65 s 2H \| 42 41 m 1H \| 41 40 dt 1H J 71 163 \| 30 29 dt 1H J 85 154 \| 28 27 m 2H \| 21 19 m 2H \| 18 17 m 2H \| 16 16 d 2H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1cc(F)c2c(=O)n(-c3cccc(-n4cc(C(N)=O)cn4)c3CO)ncc2c1	ir: 3 3 1 3 3 3 4 9 8 5 6 10 8 7 25 11 3 3 4 7 9 8 2 5 4 6 5 3 2 2 2 3 3 2 2 3 3 0 3 9 39 24 7 3 3 4 3 9 12 10 7 3 2 3 2 1 2 2 2 1 3 2 2 3 5 3 4 5 7 3 3 4 2 1 3 2 2 3 3 3 2 1 6 5 2 3 3 5 6 3 4 9 17 25 11 6 3 2 3 2 2 3 5 2 1 2 5 5 3 2 2 2 1 2 9 2 1 2 2 8 2 3 3 3 10 8 4 3 2 3 3 3 2 6 3 2 2 2 3 4 3 4 2 2 5 20 2 4 3 3 7 4 2 2 2 8 3 21 56 18 6 4 2 2 3 5 2 1 1 2 1 1 1 2 1 1 2 2 2 1 1 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 2 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 2 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 1 2 1 1 1 2 1 1 2 2 1 2 2 2 2 1 2 1 2 1 2 1 1 2 2 2 2 2 3 2 2 2 2 2 2 4 2 5 7 3 33 17 5 5 6 19 100 28 8 6 3 3 3 2 1 2 2 7 10 2 2 1 2 2 2 1 1 2 2 2 7 10 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 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1; 1HNMR: 83 82 d 2H J 166 \| 82 82 s 1H \| 78 77 dd 1H J 12 76 \| 77 77 d 1H J 23 \| 77 76 s 2H \| 77 76 dd 1H J 65 76 \| 76 75 dd 1H J 12 65 \| 74 73 dd 1H J 22 121 \| 51 51 d 2H J 57 \| 35 35 t 1H J 56 \| 14 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)CCCCCCCCCCCCO	ir: 3 2 1 4 7 2 0 1 2 2 2 3 5 2 2 8 4 1 1 0 1 1 1 0 0 0 1 0 0 1 1 1 1 1 1 2 1 2 2 7 9 5 7 3 2 1 1 1 1 4 4 1 1 1 1 2 1 1 0 1 1 3 2 15 6 5 3 7 1 2 2 1 1 1 1 1 1 3 4 2 2 1 8 2 8 29 42 19 100 39 8 5 19 42 8 4 5 5 3 4 3 2 4 2 2 5 16 11 6 3 6 2 1 2 2 2 2 2 3 15 13 2 2 2 2 1 1 2 1 1 2 2 2 2 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 0 0 0 0 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 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 1 1 1 1 3 3 12 3 3 2 3 2 3 3 3 12 19 4 2 1 1 2 1 0 2 3 17 52 7 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 36 35 q 2H J 58 \| 27 27 t 1H J 59 \| 26 25 t 2H J 60 \| 23 22 s 5H \| 16 15 m 4H \| 14 12 m 10H \| 13 12 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1ccccc1CCn1cnc(-c2cc(C(N)=O)ccn2)c1	ir: 5 10 6 6 4 3 3 1 2 1 2 2 0 2 2 1 1 1 3 1 1 3 2 1 8 2 2 1 2 4 3 1 1 2 2 2 2 4 7 14 5 16 24 4 3 2 2 2 1 2 3 2 2 2 1 0 2 2 1 1 6 5 8 22 7 2 1 0 1 4 3 1 5 3 7 2 2 8 14 8 3 3 3 4 4 2 1 2 2 3 4 7 6 10 3 2 6 8 2 5 15 2 3 3 5 3 2 5 7 5 4 4 4 5 10 7 7 8 3 5 3 4 2 10 5 6 4 5 4 2 1 3 2 1 0 3 3 13 20 2 4 1 8 22 12 3 2 2 4 29 5 3 2 3 9 31 13 2 12 13 3 7 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 1 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 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 0 1 3 3 1 2 3 4 4 5 5 3 2 3 5 5 14 13 7 24 79 39 35 8 2 3 3 1 1 1 1 1 1 1 2 1 1 4 10 2 1 1 1 1 1 1 1 1 1 2 100 2 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 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: 88 87 d 1H J 49 \| 84 84 d 1H J 22 \| 78 77 dd 1H J 22 49 \| 76 76 dt 1H J 8 17 \| 75 75 dt 1H J 8 17 \| 73 73 s 2H \| 72 71 ddd 1H J 21 71 79 \| 71 70 m 2H \| 69 68 dd 1H J 11 80 \| 42 42 tt 2H J 9 66 \| 41 40 q 2H J 63 \| 31 30 td 2H J 8 66 \| 15 14 t 3H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)c1cc(C(=O)O)nc(O)n1	ir: 0 1 2 2 2 3 2 2 2 2 3 4 6 3 7 6 14 9 15 18 17 2 1 7 1 2 2 1 1 1 3 2 2 4 5 21 35 7 1 5 4 6 4 2 2 0 1 2 2 0 4 1 2 2 3 3 18 2 2 2 1 0 1 2 3 6 5 9 3 2 13 6 6 3 3 5 2 2 5 3 2 5 5 7 0 0 1 3 1 3 4 2 1 1 1 1 0 1 3 3 1 1 1 1 0 1 2 2 1 2 2 2 2 3 5 3 3 5 2 2 5 5 4 1 2 2 2 1 0 4 8 2 1 1 3 6 7 13 41 2 1 3 23 100 13 2 12 4 12 3 2 4 4 2 1 1 1 1 1 1 1 23 2 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 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 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 2 2 1 0 1 1 1 1 1 5 5 1 6 18 10 5 2 2 3 1 1 1 17 8 1 1 0 0 1 1 1 1 1 2 2 3 3 13 6 2 3 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 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 93 93 s 1H \| 84 84 s 1H \| 76 75 m 5H \| 75 74 m 2H \| 74 73 m 1H \| 72 71 dp 2H J 9 80 \| 43 42 m 1H \| 42 41 q 2H J 64 \| 31 30 ddt 1H J 9 65 139 \| 28 27 ddt 1H J 9 64 139 \| 26 25 ddt 1H J 77 86 161 \| 19 19 dd 2H J 70 85 \| 13 12 t 3H J 63 \| 12 11 d 3H J 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1c(Oc2ccc(Cl)cc2)c2cc(S(C)(=O)=O)ccc2n1CC(=O)O	ir: 1 6 7 5 6 3 26 10 8 21 24 18 7 9 13 7 21 12 14 31 100 97 31 42 8 12 7 4 2 4 2 1 2 4 5 2 9 6 7 4 3 2 4 2 4 7 4 2 9 3 5 4 10 53 39 2 9 6 4 2 6 9 3 0 3 30 7 5 8 14 9 3 3 4 2 5 11 16 29 81 36 15 18 12 18 36 32 23 12 6 1 3 11 8 2 4 8 5 4 4 4 3 8 10 9 32 23 7 4 3 2 3 7 2 0 2 7 7 6 18 28 16 17 23 16 5 11 18 11 2 2 5 4 1 1 2 3 2 2 3 4 8 14 21 21 13 19 16 12 4 3 4 15 5 3 3 2 2 2 2 2 1 8 3 1 0 1 2 1 0 1 2 1 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 3 2 1 0 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 2 1 1 1 1 2 1 1 2 2 1 2 7 8 7 2 2 2 5 5 2 4 2 4 7 20 5 24 55 20 61 73 29 14 9 7 5 2 1 5 24 6 1 1 3 1 0 2 2 1 1 2 2 1 0 2 2 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 2 1 0 1 2 1 0 1 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 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2; 1HNMR: 84 84 d 1H J 23 \| 78 77 dd 1H J 22 86 \| 76 75 d 1H J 86 \| 74 73 m 2H \| 70 69 m 2H \| 49 49 s 2H \| 32 31 s 3H \| 22 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nc2ccccc2c2c1ncn2Cc1ccccc1	ir: 8 7 4 8 7 7 6 7 6 10 5 8 9 5 5 6 8 6 13 12 4 9 4 6 12 8 6 8 4 9 6 7 8 10 10 11 7 3 4 11 21 4 30 23 5 3 5 4 3 4 7 5 3 3 4 3 3 3 3 2 3 3 3 3 3 2 5 4 6 4 8 13 4 4 5 6 3 6 2 4 4 2 3 7 3 2 4 4 2 5 2 2 2 2 3 2 3 5 6 2 1 3 2 2 2 2 2 2 2 2 3 2 2 6 4 2 3 3 4 4 2 2 4 2 2 3 2 3 3 3 3 3 8 17 7 11 8 3 5 8 3 5 8 15 32 14 26 32 65 50 40 12 7 7 7 3 5 3 3 5 9 4 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 1 2 2 1 2 2 1 2 1 1 1 1 1 2 2 1 1 2 2 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 2 1 1 2 1 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 2 2 2 2 2 2 1 2 3 3 3 6 8 11 56 35 7 3 4 2 2 3 2 2 2 2 3 3 5 4 3 4 13 21 4 3 4 3 4 4 4 1 2 5 17 100 7 0 1 3 2 1 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 1 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 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 82 82 dd 1H J 14 77 \| 79 79 m 2H \| 77 76 m 2H \| 73 72 m 3H \| 71 71 ddq 2H J 8 15 59 \| 64 64 s 2H \| 55 55 q 2H J 8	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(CC(=O)O)c1sccc1Cl	ir: 5 4 3 4 6 5 4 4 5 13 17 20 15 8 4 5 5 3 8 22 25 100 47 49 26 20 8 6 5 3 4 4 4 3 4 4 4 3 4 5 4 7 19 18 86 29 7 7 5 3 3 5 4 3 4 6 6 7 6 5 4 3 4 5 9 6 4 6 3 3 4 4 3 3 7 7 16 29 32 54 9 14 11 8 5 3 5 10 5 4 5 5 3 4 6 5 5 5 11 10 5 10 9 6 3 6 5 4 2 4 5 4 2 5 8 5 2 5 11 7 10 13 10 12 3 5 6 4 5 11 8 19 40 25 14 5 5 6 7 8 6 14 25 44 79 22 16 6 5 8 24 45 4 5 4 3 3 4 3 2 3 4 4 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 4 2 4 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 4 6 4 3 4 5 5 4 5 7 5 4 7 12 29 10 6 13 17 38 24 11 6 6 5 0 69 57 6 6 3 3 4 4 3 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 3 3 4 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 3 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 3 3 3 4 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2; 1HNMR: 71 70 d 1H J 33 \| 69 68 d 1H J 31 \| 30 30 s 2H \| 15 15 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)N1CC(C)C(=O)NC1=O	ir: 1 1 3 1 1 2 2 1 1 2 2 1 1 1 1 2 4 7 7 3 4 5 4 3 2 3 3 4 1 3 3 6 4 3 2 4 3 4 4 1 1 3 2 1 2 5 3 6 11 61 30 56 67 18 45 6 17 8 4 7 2 2 1 1 2 4 2 2 3 22 6 10 22 4 3 1 2 3 1 0 1 1 0 1 2 1 1 0 1 1 0 1 1 1 0 1 1 1 3 1 3 3 1 2 3 5 5 10 4 5 2 2 2 1 0 2 4 7 2 6 13 5 4 7 4 5 2 2 1 5 6 7 5 7 1 2 3 1 1 2 2 1 1 2 3 1 1 4 3 3 100 33 33 14 3 1 2 2 5 79 55 39 41 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 1 1 2 2 1 1 2 2 1 2 2 1 2 2 4 7 3 5 8 4 2 2 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 3 5 15 25 12 11 11 6 3 1 2 3 1 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 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; 1HNMR: 88 87 s 1H \| 42 42 dd 1H J 45 122 \| 40 39 dd 1H J 45 122 \| 30 29 qt 1H J 44 66 \| 23 23 s 2H \| 11 11 d 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(Cc1ccc2oc(Br)cc2c1)OCc1ccccc1	ir: 1 4 8 4 1 3 2 3 1 5 18 8 2 3 3 2 1 5 3 3 4 5 5 9 12 7 3 3 4 4 9 9 9 8 8 3 7 14 8 22 17 14 13 21 9 10 5 7 4 6 6 3 10 4 10 8 10 1 1 1 1 1 2 2 2 17 9 8 14 18 3 2 1 2 1 2 3 6 4 1 1 2 0 1 3 8 24 4 11 9 9 1 3 2 2 2 3 10 13 11 6 40 19 17 3 3 1 1 1 2 2 1 3 2 2 3 3 4 8 26 8 4 5 3 6 8 7 6 7 6 5 2 8 4 8 22 7 5 6 2 7 19 13 17 40 23 13 15 4 3 31 14 4 7 6 4 2 1 1 1 1 0 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 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 0 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 2 3 5 3 2 3 1 3 3 8 14 15 15 44 82 100 59 22 13 8 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 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 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: 76 76 tt 1H J 10 21 \| 74 72 m 7H \| 71 71 d 1H J 22 \| 52 51 s 2H \| 36 36 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(CS(=O)c1ccc(O)cc1)c1ccccc1O	ir: 3 1 2 1 3 3 5 2 2 8 8 4 5 4 5 2 6 7 5 9 6 4 5 7 11 12 9 14 5 9 4 2 5 1 2 1 1 2 1 2 1 66 6 3 3 1 1 2 1 0 2 6 2 25 24 9 4 3 2 1 2 0 1 1 1 1 6 17 1 6 1 1 1 1 4 2 2 3 6 5 4 18 22 5 5 2 5 35 23 4 6 3 36 6 2 3 3 4 1 4 9 9 1 2 2 2 23 2 5 2 2 12 3 1 1 1 1 2 4 1 3 2 3 1 8 4 21 6 3 1 0 1 1 1 1 5 1 5 5 1 1 1 0 3 8 15 17 13 2 3 5 4 2 1 1 4 1 1 1 1 6 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 2 2 2 2 2 2 3 3 3 2 1 1 1 2 1 4 9 9 23 100 19 27 29 6 11 5 7 73 34 5 3 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 1 2 3 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; 1HNMR: 78 77 dd 1H J 16 81 \| 76 75 m 2H \| 75 74 td 1H J 16 81 \| 72 71 s 1H \| 71 70 td 1H J 14 79 \| 70 69 dd 1H J 14 84 \| 69 69 m 2H \| 43 43 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(C)c1-c1cccc(CO)c1C	ir: 3 2 1 2 2 1 1 1 2 2 1 2 1 2 1 3 1 1 1 1 2 1 1 1 1 1 4 4 1 0 0 0 1 0 0 2 5 3 2 2 1 0 1 2 2 4 36 16 15 2 1 1 1 1 0 1 0 1 1 0 1 3 3 2 1 1 2 2 3 3 3 5 3 3 6 4 5 4 4 2 2 9 10 27 31 37 49 60 25 21 13 13 16 8 3 2 1 1 3 2 2 1 3 2 2 3 5 3 1 1 0 1 1 1 1 1 1 1 1 1 1 1 3 2 1 8 4 3 2 1 1 2 3 4 20 7 3 5 5 14 23 5 1 1 1 0 1 2 1 0 1 1 0 1 2 7 4 4 2 4 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 0 1 1 1 0 0 0 0 0 1 0 1 0 1 2 1 1 2 2 4 5 5 5 6 2 2 3 2 4 11 10 55 56 4 3 4 3 1 3 89 100 21 2 0 1 1 1 0 0 1 0 0 1 1 1 1 2 2 1 2 3 8 2 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 t 1H J 80 \| 73 73 dd 1H J 13 80 \| 72 71 m 4H \| 47 47 dd 2H J 8 56 \| 24 24 s 6H \| 23 23 s 3H \| 22 22 t 1H J 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCc1ccc(C#N)c(OC(F)F)c1	ir: 0 2 6 3 2 5 6 4 1 4 7 3 2 3 4 3 1 4 5 3 6 4 7 4 13 17 10 3 2 4 4 2 2 12 13 2 2 5 9 2 7 10 4 1 1 4 3 1 2 5 3 2 7 8 38 4 23 17 58 51 4 4 9 14 12 5 5 1 18 7 18 11 17 16 100 18 37 49 10 5 5 2 4 3 5 5 3 4 4 8 4 3 3 3 5 7 9 3 1 2 3 3 3 2 3 2 1 2 3 2 1 2 4 3 2 5 8 8 2 6 5 6 3 3 5 4 2 3 3 2 2 3 3 3 2 3 12 34 7 8 5 8 2 3 3 2 2 3 3 37 3 5 6 9 3 3 3 1 2 4 9 4 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 9 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 2 2 1 1 2 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 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 3 3 3 4 2 6 18 10 5 6 8 9 24 73 21 10 6 5 3 7 5 4 3 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 76 75 d 1H J 83 \| 71 70 ddt 1H J 9 17 83 \| 70 70 dt 1H J 8 17 \| 67 67 s 0H \| 60 59 ddt 1H J 75 97 171 \| 52 51 m 1H \| 51 50 m 1H \| 33 33 dtt 2H J 8 15 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ncc(Cn2cc(C(=O)O)cn2)cc1-c1cccc(Cl)c1	ir: 1 1 0 1 1 1 1 2 2 3 1 1 4 2 6 2 8 2 15 4 4 22 27 39 76 27 6 1 4 3 4 10 2 1 1 4 17 5 1 5 8 4 1 1 1 1 2 15 3 3 2 2 3 3 1 2 1 4 2 2 1 1 1 0 3 4 9 9 9 6 2 1 1 0 5 4 8 69 28 4 1 1 1 1 2 1 1 1 2 10 27 17 3 1 3 7 1 1 3 2 13 2 1 0 0 0 0 0 0 0 0 1 1 2 7 2 0 1 2 2 1 1 19 6 5 26 11 8 3 1 1 2 8 6 9 16 6 2 2 5 1 1 2 0 4 16 17 3 2 1 9 12 4 0 4 13 1 3 15 5 1 0 4 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 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 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 1 0 0 1 1 0 0 0 1 1 1 0 1 3 5 0 14 31 5 5 5 11 4 4 2 1 4 100 15 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 83 dt 1H J 9 18 \| 80 80 s 1H \| 80 79 dt 1H J 8 17 \| 79 79 q 1H J 6 \| 75 75 m 2H \| 74 74 t 1H J 78 \| 74 73 ddd 1H J 13 20 79 \| 55 55 q 2H J 9 \| 41 40 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1ncc2c(NCCN3CCOCC3)nc(-c3cccc4[nH]ncc34)nc21	ir: 6 9 6 9 9 6 6 8 12 14 5 6 5 11 8 7 6 7 21 6 6 6 7 7 12 5 7 6 7 6 29 7 6 6 5 17 10 7 5 4 6 19 28 28 9 5 6 7 10 19 8 6 6 8 7 5 5 7 5 5 5 5 5 4 5 6 5 6 5 5 6 10 12 12 5 7 5 5 5 5 19 6 5 5 5 6 6 18 10 5 5 5 5 5 7 6 8 11 15 6 8 6 12 8 5 5 4 6 7 6 5 5 9 15 9 9 24 7 5 5 5 5 6 8 10 5 6 6 7 13 12 5 5 6 19 26 7 8 8 13 7 6 5 6 12 9 6 100 7 11 8 0 3 46 3 11 6 4 7 44 35 4 5 6 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 6 6 5 11 7 8 24 12 5 5 5 5 4 5 5 5 4 5 6 5 4 5 6 5 6 6 6 5 6 28 72 48 20 36 6 8 6 5 5 6 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 5 4 5 5 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 4 4 4 4 4 5 4 4 4 5; 1HNMR: 86 86 s 1H \| 82 82 t 1H J 43 \| 82 81 s 1H \| 81 80 dd 1H J 14 92 \| 78 77 m 1H \| 75 75 m 1H \| 41 41 s 3H \| 37 37 m 4H \| 36 35 td 2H J 43 61 \| 28 28 t 2H J 61 \| 26 25 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nccc(-c2cccs2)n1	ir: 8 16 18 7 7 10 10 13 6 6 3 5 10 8 7 6 2 5 8 3 3 8 8 4 8 10 5 6 18 10 6 4 4 5 5 2 3 6 5 2 4 6 2 1 4 7 6 4 8 4 14 23 17 17 30 33 20 11 20 22 19 5 12 2 7 7 7 6 2 10 8 17 12 4 7 2 3 2 2 4 2 3 5 5 3 10 5 7 3 6 1 1 2 2 1 6 4 5 2 6 2 2 1 3 6 7 7 2 5 4 1 3 2 2 5 4 3 2 1 3 2 3 2 2 2 1 1 2 2 6 4 6 4 6 4 7 5 6 6 5 4 15 10 16 39 82 49 76 26 15 17 48 4 5 9 21 73 25 11 2 3 3 2 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 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 0 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 2 1 1 1 2 1 0 1 1 1 1 1 2 1 1 2 2 2 2 3 7 15 23 7 18 33 17 11 5 5 9 2 2 1 2 2 2 2 2 2 3 8 25 21 27 25 36 13 2 4 3 1 1 2 5 29 18 100 9 41 5 2 1 2 2 1 1 2 3 1 1 1 1 0 1 1 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 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; 1HNMR: 84 84 d 1H J 38 \| 74 74 m 2H \| 73 73 dd 1H J 17 50 \| 72 72 t 1H J 49 \| 64 64 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCC(C(N)=O)(C(=O)OCC)C(F)F	ir: 2 2 1 4 4 3 3 3 2 2 2 3 3 3 2 2 3 3 3 8 3 2 4 3 4 4 4 3 2 4 4 13 9 4 3 6 5 7 2 3 2 2 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 3 2 1 2 3 1 2 2 3 6 1 2 4 4 1 3 4 2 1 1 2 2 1 1 1 1 1 2 4 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 2 2 3 3 6 3 2 2 3 3 2 2 2 2 3 3 2 2 2 1 1 1 2 1 1 2 2 3 1 2 3 14 20 5 20 19 4 2 1 1 1 4 2 5 3 28 100 52 4 0 3 4 2 0 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 5 6 5 5 1 1 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 4 5 2 1 1 1 1 1 2 2 1 3 6 36 48 8 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; 1HNMR: 75 75 s 2H \| 62 62 s 0H \| 58 56 ddt 1H J 93 110 165 \| 53 52 dq 1H J 13 165 \| 51 50 dq 1H J 14 110 \| 42 41 p 2H J 61 \| 29 28 ddtd 1H J 15 30 90 150 \| 28 27 ddtd 1H J 14 30 93 152 \| 13 12 t 3H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC12CC(=O)CC(C)(O1)C(O)C2O	ir: 8 4 14 3 5 4 3 5 4 1 1 3 3 5 19 15 11 5 1 2 2 2 1 2 3 1 2 2 2 1 1 2 1 1 1 2 2 1 2 2 5 8 7 8 3 1 2 4 3 2 1 3 3 5 1 2 1 0 1 2 2 3 6 3 1 3 3 2 3 3 4 4 2 3 5 2 2 2 5 3 3 2 11 16 13 30 33 36 75 89 49 48 11 1 7 4 6 3 2 3 2 1 2 3 1 2 2 2 2 1 1 2 1 2 1 2 2 4 5 4 3 14 14 10 3 3 4 2 2 4 13 6 2 1 1 1 1 1 1 1 0 1 5 10 10 15 3 3 2 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 0 1 0 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 2 1 1 1 1 3 3 3 2 0 4 6 6 4 2 4 3 3 6 4 29 17 4 2 1 6 6 2 11 22 35 100 46 15 9 4 2 1 3 3 1 1 2 1 1 1 2 2 1 1 1 1 1 1 1 2 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 47 46 m 2H \| 39 38 m 2H \| 29 29 d 2H J 170 \| 27 26 d 2H J 172 \| 14 14 d 6H J 12	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)NC[C@H]1CN(c2ccc3c(c2)CCCC(=Cc2ccc(O)cc2)C3=O)C(=O)O1	ir: 4 6 14 4 3 4 2 4 14 12 7 6 5 4 5 6 5 2 2 4 2 3 2 3 2 1 4 7 5 8 12 14 6 7 7 5 4 4 2 5 6 5 3 5 7 11 3 2 3 4 2 2 4 6 8 10 18 8 3 1 4 3 3 3 2 4 7 5 9 13 5 3 2 2 2 4 3 3 7 13 34 7 6 5 7 3 3 12 7 2 8 7 6 1 4 4 4 1 2 2 1 8 16 5 3 5 6 9 3 4 6 5 3 2 3 4 3 6 10 7 6 10 11 7 9 10 17 9 8 12 5 6 2 5 3 2 3 2 4 4 5 3 7 12 16 100 63 12 10 12 38 33 7 6 10 14 6 4 2 1 1 2 5 10 2 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 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 2 1 0 1 2 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 0 1 2 1 1 1 2 2 2 1 3 2 2 1 4 3 2 2 3 2 1 2 5 8 15 19 32 26 9 4 3 3 2 4 13 20 3 2 1 1 1 1 2 1 1 3 8 5 12 14 8 8 6 3 3 2 2 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 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: 79 78 d 1H J 83 \| 76 76 t 1H J 9 \| 74 74 m 3H \| 73 72 m 2H \| 69 68 m 2H \| 58 58 s 1H \| 47 47 m 1H \| 42 41 dd 1H J 16 130 \| 39 38 dd 1H J 33 129 \| 36 35 ddd 1H J 42 69 134 \| 34 33 ddd 1H J 41 69 134 \| 29 29 td 2H J 8 87 \| 28 28 td 2H J 9 79 \| 20 19 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCCCCCCCCC1=C(O)C(=O)C=C(NCCCCCC)C1=O	ir: 2 9 27 6 3 3 6 5 7 10 35 28 41 17 23 25 15 27 22 3 10 9 1 2 2 1 1 7 2 1 0 1 2 1 0 2 2 3 2 2 3 7 2 2 2 1 2 2 2 1 2 5 4 4 1 2 2 3 2 3 1 0 2 5 2 2 42 16 19 5 3 1 2 1 3 1 1 1 1 1 1 3 16 3 2 1 1 1 1 1 1 1 3 3 9 29 45 6 4 1 1 2 3 4 3 10 8 21 7 4 9 4 4 5 5 2 5 3 5 7 7 3 22 3 3 2 2 4 1 1 1 1 1 6 7 1 3 1 2 3 17 21 5 4 2 1 1 3 2 12 5 61 3 2 1 0 1 1 1 0 1 1 1 1 3 3 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 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 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 2 2 3 5 3 3 2 2 1 2 3 4 7 11 2 3 1 4 10 3 2 4 6 8 100 13 1 2 2 1 1 1 1 0 0 2 2 5 3 4 13 39 26 6 4 2 2 2 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 0 1 1 1 1 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0; 1HNMR: 80 79 s 1H \| 67 66 t 1H J 48 \| 57 56 s 1H \| 33 32 q 2H J 52 \| 30 30 t 2H J 84 \| 17 16 tt 2H J 73 85 \| 16 15 tt 2H J 53 68 \| 14 13 m 4H \| 13 12 m 22H \| 9 8 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(C)CCC(=O)N(Cc2ccc(C#Cc3ccccc3)cn2)C1	ir: 1 1 3 4 6 2 1 2 2 0 0 1 1 7 2 6 1 2 1 0 1 1 2 3 15 1 2 1 2 1 3 10 1 1 3 1 6 6 5 7 10 2 1 1 1 1 2 5 5 3 3 3 1 1 6 34 2 2 8 1 1 1 3 2 1 2 1 2 3 7 3 1 0 0 0 1 0 1 1 1 1 0 1 9 5 3 0 1 5 2 7 1 2 1 0 0 1 0 2 1 1 1 0 0 0 1 3 0 1 1 1 6 1 0 1 0 3 2 2 6 7 4 5 11 6 5 2 2 4 4 1 17 3 8 17 9 4 2 3 1 1 1 15 19 4 0 0 4 11 100 12 1 2 3 1 0 1 15 1 0 6 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 1 0 1 1 2 2 1 1 1 1 2 3 6 11 10 14 23 21 1 6 5 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 87 87 d 1H J 18 \| 79 79 dd 1H J 18 79 \| 76 76 m 2H \| 74 73 m 4H \| 73 73 dt 1H J 9 79 \| 46 45 d 2H J 9 \| 35 34 s 2H \| 25 24 m 2H \| 18 17 m 2H \| 10 9 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)NCC1CCN(c2nc(Cl)nc3ccoc23)CC1	ir: 15 10 11 7 7 9 9 4 3 7 6 2 5 4 3 11 5 17 22 7 3 2 5 3 4 9 11 16 23 11 11 3 7 4 3 3 3 6 14 100 28 11 5 6 3 2 2 2 2 2 1 2 2 2 2 5 5 3 4 1 2 3 4 2 5 2 2 2 2 2 2 2 4 2 3 2 2 1 2 2 1 1 5 30 8 31 4 2 2 2 4 11 5 3 4 5 13 15 14 7 11 10 5 8 17 4 6 8 7 4 19 56 7 9 7 3 5 13 3 6 4 7 12 8 7 10 2 6 5 9 26 9 14 13 5 18 4 6 4 17 4 9 10 16 29 23 85 39 20 59 40 6 31 15 72 67 7 0 1 3 2 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 1 2 2 1 2 2 4 3 3 5 3 4 3 3 3 3 3 7 10 18 15 4 0 9 18 10 11 12 3 2 1 2 2 2 2 2 2 1 1 1 2 1 1 3 8 13 44 61 14 7 3 2 1 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 d 1H J 16 \| 71 71 d 1H J 14 \| 47 46 m 1H \| 39 38 m 2H \| 34 33 m 2H \| 32 31 dd 2H J 46 60 \| 21 20 m 2H \| 18 17 m 4H \| 14 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1cccc(C(O)c2cc(Cl)ccc2NCc2ccc(OC)cc2OC)c1OCC	ir: 2 6 4 5 3 3 8 28 6 17 34 12 19 31 11 21 4 6 8 17 4 17 4 8 9 5 5 2 10 13 10 8 11 4 14 3 4 12 25 5 10 5 16 14 13 14 4 36 22 2 4 6 3 19 29 15 6 2 11 10 3 6 8 8 4 8 10 14 91 8 9 12 9 10 14 5 9 8 7 6 5 13 17 26 23 19 73 32 44 27 15 10 9 13 12 7 5 7 4 9 7 16 22 8 15 12 4 3 2 6 9 7 6 5 7 8 9 9 6 8 9 24 11 14 13 5 5 5 9 6 2 2 10 6 6 11 11 8 11 11 39 5 2 5 12 2 12 17 53 30 6 11 52 21 26 16 5 13 4 2 1 1 15 5 1 2 1 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 0 1 1 0 0 1 1 1 1 1 2 1 1 2 1 2 2 2 3 3 1 2 3 3 3 4 7 4 17 7 5 11 15 15 29 100 38 15 5 5 5 7 18 85 13 8 3 3 3 5 2 2 3 4 1 1 7 5 29 45 45 9 29 13 6 7 9 3 2 2 2 1 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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 73 dd 1H J 7 21 \| 72 71 m 3H \| 70 70 m 1H \| 69 68 dd 2H J 14 81 \| 66 65 dd 1H J 23 85 \| 65 64 d 1H J 23 \| 63 63 t 1H J 55 \| 60 59 dd 1H J 9 53 \| 46 45 dd 2H J 9 55 \| 42 41 m 4H \| 38 38 d 6H J 33 \| 34 34 d 1H J 51 \| 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.
CC(C)(C)OC(=O)N1CC[C@H](S(=O)(=O)c2ccc3nc(N)sc3c2)C1	ir: 12 9 11 8 5 30 3 17 13 26 69 48 56 32 20 14 16 22 10 11 10 15 4 4 6 4 9 5 6 5 7 4 6 6 3 6 4 13 12 8 9 3 8 7 6 2 3 5 4 2 3 3 3 7 13 22 6 7 4 3 3 9 5 14 4 26 26 3 14 3 2 1 2 2 5 1 3 29 10 5 21 37 9 7 21 37 14 3 5 3 2 10 4 4 4 12 11 3 4 15 37 8 34 33 8 5 3 2 5 2 3 12 25 8 4 13 7 4 5 6 8 5 7 29 9 5 5 5 2 11 7 11 18 42 4 3 3 2 2 2 3 3 2 17 5 3 9 4 7 9 28 100 53 29 13 7 8 2 2 5 5 9 3 4 3 1 1 2 2 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 2 1 1 2 1 1 2 2 1 1 1 1 1 2 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 1 2 1 1 1 1 2 1 1 2 2 2 2 2 3 5 2 2 4 8 3 4 2 3 12 10 6 7 28 18 9 27 35 9 8 4 4 2 2 2 2 3 3 3 2 4 2 3 0 15 81 4 8 3 2 3 2 4 2 5 6 14 47 29 16 4 1 2 4 2 0 1 2 1 1 1 3 2 0 1 2 1 1 1 2 1 1 1 2 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; 1HNMR: 82 82 d 1H J 21 \| 80 80 d 1H J 84 \| 79 78 dd 1H J 21 85 \| 53 52 s 2H \| 40 39 m 2H \| 38 38 m 1H \| 37 36 dddd 1H J 19 59 77 115 \| 36 35 ddd 1H J 57 75 112 \| 23 22 dtd 1H J 57 74 133 \| 21 20 ddt 1H J 55 75 132 \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCC(CCC)n1nc(CCC)c2c(=O)[nH]c(Cc3ccc4c(c3)OCO4)nc21	ir: 1 1 2 2 2 3 2 2 2 2 2 2 2 3 1 3 2 2 2 2 2 1 3 3 5 3 3 3 3 2 1 1 2 1 2 4 3 5 5 6 4 3 2 2 2 3 4 5 10 25 21 19 10 8 4 4 4 3 3 2 3 3 2 3 5 10 9 10 10 4 3 2 2 1 2 2 1 2 1 1 1 1 1 1 1 10 5 2 2 3 3 2 1 2 1 2 3 4 2 3 1 2 1 1 2 2 2 2 3 4 9 4 3 5 4 2 3 5 4 8 3 3 3 2 2 2 4 3 2 2 2 1 2 3 3 2 2 2 2 6 3 4 6 2 2 2 5 12 2 3 5 0 40 0 1 3 2 1 1 3 7 15 100 8 2 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 3 3 7 2 2 2 3 3 3 3 18 14 5 7 8 16 3 3 2 2 1 1 1 1 2 1 1 1 1 2 2 1 1 1 2 3 5 23 8 19 11 2 5 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 68 68 ddt 1H J 9 17 88 \| 68 67 d 1H J 88 \| 67 67 dt 1H J 8 17 \| 59 59 s 2H \| 47 47 p 1H J 40 \| 39 39 t 2H J 9 \| 31 30 t 2H J 61 \| 20 12 m 17H \| 10 10 t 3H J 80 \| 9 8 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Sc2ccc(C=[N+]([O-])C(C)(C)C)o2)cc1	ir: 2 2 2 4 5 7 6 6 5 3 3 7 6 7 4 4 3 3 3 1 2 2 2 2 2 2 2 2 1 2 2 1 2 7 4 1 1 2 7 18 4 3 4 7 13 6 2 9 8 5 4 4 5 26 49 100 48 30 22 2 13 17 19 12 5 4 3 1 22 32 2 1 2 4 3 14 8 3 3 3 2 1 14 8 5 4 8 2 2 2 9 8 4 3 2 6 7 5 1 2 2 3 8 1 4 6 13 5 4 9 12 5 2 2 1 2 5 7 6 7 9 14 5 6 4 3 7 4 11 6 10 16 7 1 1 2 2 2 3 2 1 1 1 2 4 18 42 5 65 46 1 13 19 4 4 8 16 2 1 2 8 5 2 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 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 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 2 2 1 1 2 2 1 1 3 3 2 2 3 2 1 2 2 2 2 2 7 7 25 15 17 44 71 29 13 41 18 11 4 2 2 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 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; 1HNMR: 78 77 s 1H \| 74 73 m 2H \| 71 71 d 1H J 49 \| 69 69 d 1H J 48 \| 69 69 m 2H \| 38 38 s 3H \| 16 16 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)c1ccc(Nc2cc(CCc3ccccc3)ccc2C(=O)O)cc1	ir: 1 1 1 1 1 1 2 3 3 2 1 3 8 4 5 4 2 2 3 3 9 19 15 4 4 5 5 4 8 10 10 7 7 4 1 1 2 2 4 8 9 2 3 3 2 1 1 1 1 1 1 1 1 1 4 4 6 8 3 0 1 0 1 1 1 1 2 0 3 4 4 5 1 3 3 1 2 8 18 8 2 1 1 1 0 1 3 1 1 2 1 1 1 1 3 2 2 2 1 1 0 1 2 1 1 1 1 8 2 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 0 0 0 1 1 1 4 3 1 1 5 2 2 5 10 3 2 2 1 1 1 1 1 1 3 5 0 11 17 3 3 2 0 1 4 2 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 0 0 0 1 0 0 0 0 0 0 0 1 0 1 1 1 2 5 8 16 12 3 3 2 1 0 1 1 5 100 4 1 1 0 0 0 0 1 0 2 2 1 5 9 14 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 78 78 d 1H J 81 \| 73 72 m 4H \| 72 71 m 2H \| 70 70 dt 1H J 9 19 \| 70 69 ddt 1H J 9 20 82 \| 69 68 m 2H \| 68 67 m 2H \| 29 29 s 5H \| 29 28 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(OCc2ccc(F)cc2F)c(Br)c(=O)n1-c1cccc(CN)c1	ir: 4 5 2 2 5 6 1 2 2 3 1 2 3 1 1 3 3 2 1 3 4 2 2 3 3 1 2 2 3 2 3 5 7 2 3 4 3 2 3 7 3 2 3 3 7 5 7 42 25 4 5 10 12 21 8 3 6 8 7 7 2 1 4 4 4 5 17 34 22 4 21 21 64 18 43 19 24 14 9 3 14 5 3 2 2 1 3 3 1 2 9 10 5 4 4 7 4 4 3 3 1 8 5 3 2 2 2 2 1 2 2 2 2 2 5 2 2 3 3 5 6 11 7 5 4 11 6 4 10 7 5 41 32 52 17 7 5 7 7 9 8 15 4 5 2 4 2 0 3 22 4 7 27 5 3 20 70 6 24 15 10 10 13 2 2 4 2 1 1 3 2 0 1 3 1 0 2 3 2 1 2 2 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 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 3 2 1 2 4 2 3 3 8 5 10 9 100 56 22 4 4 2 1 3 3 3 5 4 8 16 33 25 18 5 6 11 10 3 82 44 2 4 6 3 2 2 2 1 1 2 1 1 1 1 1 2 2 1 1 2 1 1 1 2 1 1 2 2 2 1 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 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; 1HNMR: 75 74 tt 1H J 9 22 \| 74 73 m 3H \| 71 71 ddq 1H J 9 20 76 \| 69 69 m 1H \| 69 68 m 1H \| 64 63 q 1H J 13 \| 53 52 dd 2H J 8 36 \| 40 39 tt 2H J 9 63 \| 24 24 d 3H J 13 \| 15 14 t 2H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)Cc1ccc(OCC(C)=O)cc1	ir: 2 3 2 2 2 1 0 2 2 3 2 4 4 2 2 2 2 2 2 1 1 1 1 1 2 4 2 1 0 0 0 1 1 1 1 1 1 1 2 2 1 1 1 1 3 2 1 2 3 1 2 1 2 4 6 17 8 2 2 1 0 1 1 1 9 2 3 2 2 7 1 2 1 1 2 1 1 0 1 1 0 0 0 1 0 0 1 4 1 1 1 2 1 1 1 5 1 3 4 3 1 8 20 2 1 1 0 1 0 0 0 0 0 1 1 1 1 2 3 2 6 4 1 3 1 5 9 7 2 2 2 2 1 1 1 1 1 1 2 1 2 7 45 6 34 5 2 6 28 10 5 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 2 1 1 1 2 1 1 1 1 2 3 5 11 5 17 100 17 7 3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 72 72 dt 2H J 9 87 \| 69 68 m 2H \| 47 47 s 2H \| 37 36 s 3H \| 36 36 d 2H J 9 \| 23 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)NCC1(CN2CCN(Cc3ccccc3)CC2)CCCCC1	ir: 14 6 5 14 11 3 2 5 11 5 5 4 2 3 4 3 2 2 2 5 2 2 9 6 6 15 22 30 59 34 24 12 16 9 3 3 5 5 6 5 100 6 6 13 4 1 8 18 8 9 5 2 2 4 4 1 3 9 2 5 3 6 25 7 3 2 3 5 11 5 3 1 2 4 1 1 3 6 2 5 59 37 7 11 10 4 5 5 8 6 3 4 2 2 4 8 7 5 13 15 31 13 5 5 2 5 3 4 2 4 12 8 1 4 3 3 2 3 7 8 7 11 5 3 7 10 17 15 48 27 11 12 17 14 5 49 5 5 3 2 2 5 17 37 27 81 65 11 14 60 28 16 5 3 2 0 1 4 3 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 1 1 1 1 0 1 1 0 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 1 1 1 1 1 1 1 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 3 2 4 3 4 5 6 3 2 3 6 5 13 27 19 32 67 11 5 4 4 2 2 3 2 2 2 2 3 2 2 1 1 1 1 2 1 3 4 26 69 96 8 7 4 2 2 3 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 0 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 73 72 m 5H \| 52 51 t 1H J 55 \| 37 36 m 2H \| 33 32 d 2H J 55 \| 28 27 m 4H \| 26 26 m 4H \| 25 25 s 2H \| 16 15 m 4H \| 15 13 m 6H \| 14 14 s 10H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OCc2ccccc2)cc(Cl)c1Cl	ir: 2 1 1 1 1 1 1 4 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 1 1 1 1 1 2 3 12 2 3 3 14 3 1 3 6 28 33 6 3 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 1 1 2 2 12 5 27 11 6 4 2 1 2 5 2 3 4 2 1 1 1 1 2 1 1 1 3 4 2 2 1 2 2 1 2 4 9 4 1 2 2 1 1 2 2 2 2 1 1 1 1 1 1 1 1 1 2 2 3 3 3 2 1 2 4 2 1 1 2 2 3 3 9 59 7 2 0 2 3 1 10 18 7 4 5 2 1 1 2 4 4 2 13 9 2 1 1 3 7 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 2 1 1 2 1 0 1 3 2 5 10 13 21 100 27 5 3 5 2 2 3 4 2 3 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 74 74 ddt 2H J 9 15 66 \| 74 73 m 2H \| 73 73 m 1H \| 69 69 d 1H J 20 \| 64 64 d 1H J 22 \| 50 49 d 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.
CCCN(CCl)C(=O)C(Cl)Cl	ir: 7 10 6 23 12 2 3 2 0 2 2 2 2 3 2 2 1 3 3 1 6 5 7 7 3 6 29 33 22 7 5 3 1 3 6 1 2 24 70 5 5 9 16 43 20 8 6 6 17 7 2 1 2 3 3 5 18 7 2 1 1 3 2 0 1 2 1 0 2 6 4 1 3 5 5 0 1 1 1 0 1 2 2 8 10 22 3 1 2 6 9 16 13 3 1 1 1 1 1 5 6 1 2 2 3 2 1 3 7 19 4 8 3 4 1 2 4 11 23 8 4 2 7 13 35 11 8 14 50 11 2 3 4 2 1 3 8 4 4 3 2 1 1 3 3 8 100 15 4 2 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 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 3 2 4 6 3 5 2 4 19 13 26 24 21 4 2 1 2 1 1 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 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 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 65 65 s 1H \| 50 49 s 2H \| 34 34 t 2H J 65 \| 17 16 qt 2H J 65 79 \| 9 8 t 3H J 79	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cc(N2CCOCC2)ccc1N	ir: 1 2 3 2 3 3 3 3 2 3 4 2 2 6 9 12 1 14 5 6 6 7 12 7 17 13 7 2 2 3 4 3 3 4 7 6 3 8 5 2 6 74 8 11 22 34 7 4 6 3 4 4 7 5 14 1 5 4 2 0 2 8 3 0 3 5 3 2 9 7 2 1 1 7 1 0 6 4 2 3 16 4 1 2 2 2 2 3 3 2 2 3 6 3 2 5 3 5 7 13 15 4 1 1 3 2 1 1 3 3 1 5 3 2 1 3 5 3 1 2 3 2 1 2 3 1 1 3 4 2 1 2 3 3 1 5 15 46 18 6 3 1 4 8 6 3 5 24 42 6 3 8 23 34 7 10 8 33 42 11 3 4 9 5 5 5 2 3 2 0 1 3 2 1 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 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 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 2 2 2 1 3 14 4 3 4 13 18 22 12 8 11 2 3 3 1 0 2 3 2 1 2 2 2 1 3 10 20 3 3 16 71 21 17 13 3 2 11 100 59 7 4 3 2 2 2 2 1 1 2 2 1 2 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 2 1 2 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 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 81 81 d 1H J 22 \| 76 75 dd 1H J 22 84 \| 74 73 dq 1H J 11 84 \| 73 73 d 1H J 22 \| 73 72 d 1H J 73 \| 69 69 dd 1H J 22 86 \| 67 66 d 1H J 87 \| 67 66 s 2H \| 39 38 m 4H \| 34 34 m 4H \| 31 30 dp 1H J 47 73 \| 24 23 d 3H J 11 \| 10 9 m 2H \| 7 6 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ncn2cc(Br)sc12	ir: 13 16 20 9 12 8 11 67 20 7 7 7 6 6 6 7 7 6 9 16 28 14 25 10 10 7 7 7 8 6 15 7 7 6 7 7 13 7 7 8 8 17 46 39 11 4 38 7 6 7 10 8 8 6 6 7 6 6 7 8 9 6 7 7 7 6 7 6 7 7 20 10 12 49 12 13 9 7 7 9 19 41 8 7 7 8 8 7 23 17 10 7 7 6 8 18 13 8 8 13 11 14 9 12 9 6 8 7 6 7 7 7 6 13 73 35 9 9 12 10 7 8 9 12 7 10 10 10 7 8 8 8 6 7 7 6 6 7 7 6 6 8 7 20 21 9 8 6 6 9 11 6 6 7 6 5 6 7 6 5 6 7 6 6 6 0 46 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 7 7 5 6 7 7 6 6 7 7 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 7 7 6 5 6 7 6 5 7 7 6 5 6 7 6 6 6 7 6 6 7 7 6 6 7 7 6 6 7 7 7 10 8 7 6 7 8 7 6 6 10 7 6 9 27 35 10 8 10 8 100 48 17 7 7 6 6 6 6 6 7 6 6 6 6 6 6 6 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 7 6 6 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 5 6 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 7 6 6 6 7 6 5 6 7 6 5; 1HNMR: 77 77 s 1H \| 71 71 s 1H \| 39 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)c1ccc(N)cc1	ir: 7 9 5 30 2 6 2 5 4 5 3 2 2 2 2 1 2 2 2 3 2 3 2 4 4 5 4 5 5 23 13 2 4 6 7 3 3 2 2 3 4 5 3 29 65 16 6 5 3 4 3 3 3 5 4 6 11 9 3 1 1 4 1 1 1 1 1 1 2 6 2 2 1 1 3 1 1 4 4 6 2 2 8 2 1 1 0 1 1 10 2 1 1 3 1 1 2 1 3 5 22 5 1 1 3 3 27 2 1 1 2 1 1 1 2 1 1 2 9 2 2 2 2 1 2 1 2 1 2 2 3 2 2 1 1 1 1 11 2 4 2 5 5 8 46 3 2 0 2 60 18 20 9 24 15 28 18 14 12 1 1 1 1 8 20 2 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 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 1 1 1 1 1 1 0 1 0 1 1 1 2 2 6 21 13 7 14 34 8 2 2 1 1 1 1 1 0 1 0 1 1 1 1 1 25 16 6 2 2 6 46 37 11 6 13 5 100 38 8 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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; 1HNMR: 79 79 m 2H \| 78 77 m 4H \| 76 76 dd 1H J 17 50 \| 75 75 dd 1H J 17 61 \| 74 73 dd 1H J 22 81 \| 72 72 dd 1H J 50 61 \| 66 66 m 2H \| 46 45 s 2H \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=C(C)CCc1ccc(C(=O)O)cc1	ir: 5 5 4 5 5 5 5 5 5 5 5 7 5 6 8 7 8 10 11 12 19 100 22 66 6 6 6 5 5 6 5 5 5 5 5 5 4 5 5 4 4 5 5 4 5 5 5 4 5 5 5 5 5 5 8 7 10 9 5 4 4 5 5 5 5 7 7 7 7 10 5 5 6 14 7 17 8 9 12 10 13 5 5 5 5 5 6 6 8 7 5 6 5 5 4 4 4 5 5 8 5 4 4 4 5 5 5 5 5 5 4 5 6 5 6 17 8 7 10 6 7 7 6 7 5 7 8 5 5 4 4 4 5 5 4 5 5 5 6 5 5 12 19 11 15 5 5 5 5 17 12 6 12 5 5 6 6 6 7 5 5 5 6 5 4 4 4 4 4 4 4 4 5 4 5 5 4 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 5 5 6 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 4 5 4 4 4 5 4 4 5 5 5 4 4 5 5 4 4 5 5 6 6 8 6 4 9 9 18 9 14 8 8 7 12 11 5 0 82 58 10 7 4 3 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 4 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4; 1HNMR: 79 79 m 2H \| 73 72 dt 2H J 9 82 \| 49 48 hept 1H J 13 \| 47 46 dq 1H J 10 20 \| 27 27 tt 2H J 9 74 \| 24 23 tt 2H J 11 74 \| 17 17 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(C(=O)Nc2ccc(Br)cc2C#N)cc1	ir: 6 7 9 9 10 5 4 4 4 7 8 9 9 14 15 22 6 7 4 4 3 4 3 4 3 4 5 7 7 6 8 6 11 6 4 3 3 3 8 18 16 22 44 30 20 6 4 0 3 5 5 5 10 16 34 45 22 11 5 3 3 3 4 7 23 19 7 6 11 12 5 2 4 7 7 3 5 5 4 4 3 6 8 21 35 23 13 23 26 27 9 8 4 3 4 5 3 32 18 22 9 3 2 2 3 2 1 2 3 2 2 3 4 3 2 4 9 4 3 7 4 7 4 7 33 7 1 3 3 2 2 3 3 2 2 3 15 2 1 3 4 2 4 63 27 15 11 39 39 37 13 11 39 12 14 6 3 4 2 3 6 6 5 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 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 3 3 5 4 2 11 24 70 100 47 21 10 11 5 3 3 3 2 2 2 2 2 2 2 2 3 3 4 4 5 11 13 58 23 10 8 3 6 3 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; 1HNMR: 82 81 m 2H \| 79 79 m 3H \| 76 76 d 1H J 72 \| 76 75 dd 1H J 21 72 \| 73 73 m 2H \| 71 71 m 2H \| 33 33 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCC(O)CCC1C(CCCCCCC(=O)OCC)CC(O)C1O	ir: 1 1 0 3 2 3 1 1 2 2 3 2 2 2 1 1 1 2 0 1 1 1 2 2 0 1 0 1 1 0 0 0 0 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 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 0 0 1 2 2 2 5 3 16 31 4 3 3 2 1 1 0 1 2 1 1 1 2 1 2 1 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 1 2 4 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 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 2 2 1 1 2 1 1 1 1 2 4 1 1 1 1 1 1 4 8 11 100 7 7 3 2 1 1 0 0 0 1 0 0 0 1 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 42 41 q 2H J 66 \| 39 38 ddd 1H J 47 55 104 \| 38 37 d 1H J 46 \| 37 36 m 2H \| 34 34 d 1H J 42 \| 28 27 d 1H J 53 \| 23 22 t 2H J 85 \| 19 18 m 2H \| 18 17 ddt 1H J 57 68 92 \| 17 16 m 1H \| 16 16 m 1H \| 16 16 d 1H J 19 \| 16 15 m 2H \| 15 11 m 22H \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(O)C(=N)/C(=N\OCc1cccc(NC(=O)OC(C)(C)C)n1)c1ccccc1	ir: 6 10 6 9 8 10 11 10 10 8 7 20 27 7 12 17 11 11 10 13 10 9 7 10 9 9 7 6 8 9 16 9 9 9 18 10 15 12 15 15 8 9 13 8 7 12 23 35 19 9 7 4 5 6 5 4 5 5 6 4 4 5 6 5 7 5 6 6 11 7 8 5 5 6 14 6 6 6 6 5 6 7 8 10 21 11 18 9 10 5 5 7 6 8 9 11 12 10 6 10 8 5 7 13 5 7 8 6 4 13 5 5 4 6 6 4 4 5 5 5 6 7 6 5 8 6 5 6 4 12 10 11 6 5 7 7 13 8 21 21 11 10 31 12 12 7 6 21 21 12 11 17 7 2 6 17 27 74 16 0 3 7 4 2 3 5 4 2 3 4 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 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 3 3 3 3 3 3 4 4 3 3 3 4 3 3 4 4 3 3 3 4 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 4 3 4 4 4 4 4 4 4 4 4 5 5 7 29 7 14 46 22 9 6 5 14 63 100 71 8 5 5 5 4 3 5 6 41 4 5 4 4 6 11 24 57 9 5 4 4 3 3 3 3 3 3 4 3 3 3 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 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: 85 84 s 1H \| 83 83 s 1H \| 82 81 s 1H \| 78 77 m 5H \| 75 75 m 2H \| 75 74 m 1H \| 72 71 ddt 1H J 9 18 71 \| 52 52 d 2H J 9 \| 36 36 q 2H J 76 \| 15 14 s 8H \| 13 12 t 3H J 76	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OC(C1=NN(c2ccccc2Cl)C(c2ccc(Br)c(F)c2)C1)(C(F)(F)F)C(F)(F)F	ir: 16 4 4 3 3 3 3 2 10 4 3 3 2 2 3 3 3 5 2 3 2 2 2 2 6 2 2 2 2 2 3 2 2 2 2 2 2 2 2 3 6 2 10 27 4 4 3 12 3 2 2 3 5 11 10 13 6 4 4 5 6 3 3 3 2 4 11 6 5 2 3 2 4 2 3 5 3 2 2 4 4 4 4 3 3 3 3 12 26 4 8 14 5 4 3 33 20 20 13 4 1 3 3 2 1 2 2 2 2 3 3 7 3 4 5 21 4 2 2 2 2 3 3 2 2 2 3 2 3 3 4 5 2 2 2 2 2 10 3 4 3 5 9 3 3 3 3 7 13 4 2 3 4 2 2 2 2 2 2 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 3 2 2 2 2 2 2 3 2 2 2 2 2 3 3 5 5 15 18 13 11 4 1 4 5 5 100 8 0 2 3 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 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: 76 75 dd 1H J 47 96 \| 74 74 m 2H \| 74 73 dd 1H J 12 83 \| 73 71 m 3H \| 53 52 m 1H \| 50 49 hept 1H J 34 \| 33 32 dd 1H J 48 143 \| 29 28 dd 1H J 48 143	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(c2cccc(-c3nc4ccc(Cl)cc4o3)c2)COCC(=O)N1	ir: 3 2 4 5 5 5 4 4 9 15 7 21 23 7 15 10 5 3 3 4 3 6 4 17 8 3 3 4 6 2 6 100 56 11 7 6 3 5 3 2 3 5 5 4 7 7 7 53 20 7 12 5 5 4 10 14 5 4 3 4 3 8 9 5 3 3 13 43 6 7 4 3 2 3 24 5 3 4 3 6 8 5 3 3 0 13 2 4 4 7 3 2 3 3 8 2 4 2 4 4 6 2 2 4 8 3 4 10 8 3 4 9 4 2 2 2 7 4 3 5 8 6 15 7 23 12 5 44 17 7 9 13 9 19 27 8 4 4 5 5 26 6 19 37 12 36 4 3 3 6 24 4 31 98 18 8 4 5 3 3 3 2 3 2 3 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 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 3 2 3 2 3 4 3 3 2 3 4 6 10 21 27 35 100 42 11 5 7 3 2 4 2 3 3 3 3 3 3 2 2 3 3 2 4 6 10 10 20 35 19 7 16 5 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 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: 79 79 ddd 1H J 12 22 95 \| 79 78 t 1H J 22 \| 78 77 d 1H J 78 \| 76 75 dd 1H J 78 96 \| 75 74 m 5H \| 44 43 d 1H J 121 \| 42 42 d 1H J 147 \| 42 41 m 2H \| 18 17 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(-c2cc3nc(C#N)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(Cl)c(F)c2)c1	ir: 4 4 2 2 5 9 2 3 2 3 2 2 2 2 3 5 3 2 3 1 2 2 3 5 1 2 2 3 2 2 2 3 3 3 6 2 2 3 2 5 5 23 3 2 4 2 5 7 3 2 4 2 2 3 14 0 2 3 2 3 2 2 1 1 2 3 2 3 3 4 1 2 2 3 3 1 2 1 2 1 2 3 2 2 2 3 5 2 2 2 1 2 3 8 3 2 2 2 2 1 4 2 5 3 2 1 2 2 2 4 5 2 2 2 2 4 5 3 3 4 2 3 3 3 4 3 3 3 4 6 2 3 2 2 3 7 4 7 10 5 3 6 7 4 2 1 2 3 2 3 4 2 5 3 27 1 32 100 6 4 2 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 2 2 3 2 2 3 3 2 4 3 8 18 8 13 4 2 2 2 2 1 2 2 2 1 2 1 1 1 2 2 1 2 4 4 3 10 19 7 2 4 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 74 m 1H \| 74 74 m 1H \| 74 73 dd 1H J 48 86 \| 73 72 m 2H \| 72 71 ddt 1H J 9 18 88 \| 71 71 ddt 1H J 9 16 121 \| 66 65 s 1H \| 59 58 t 2H J 9 \| 57 56 d 1H J 62 \| 39 38 ddt 1H J 54 62 115 \| 24 24 m 2H \| 18 16 m 6H \| 16 14 m 2H \| 13 12 dd 3H J 15 53	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)[C@@H]1CC[C@@H](Oc2ccc(F)cc2)CC1	ir: 3 2 4 4 4 5 6 9 9 14 7 9 4 4 3 2 2 1 1 2 1 1 0 1 1 1 1 2 1 1 1 2 4 1 4 2 4 1 3 2 1 1 1 2 1 0 1 2 2 2 3 5 5 8 47 24 24 23 8 5 3 2 2 4 2 4 3 6 21 6 2 3 4 4 5 9 3 4 2 1 0 0 1 1 1 1 5 3 2 1 1 1 1 1 2 2 2 4 4 3 2 7 2 2 2 3 6 6 16 30 23 18 21 10 4 5 9 8 5 4 2 2 7 6 4 6 3 1 2 2 3 2 1 3 5 4 3 2 2 1 2 4 4 18 39 13 42 100 9 4 8 7 21 1 3 1 2 1 1 0 1 2 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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 1 0 1 1 0 1 1 1 0 1 2 2 2 3 4 8 6 2 5 5 3 6 14 24 8 16 37 38 8 2 2 2 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0; 1HNMR: 70 70 m 2H \| 69 68 m 2H \| 45 44 tt 1H J 34 62 \| 37 36 s 2H \| 25 24 tt 1H J 47 74 \| 21 20 dddd 2H J 47 59 86 133 \| 20 19 m 2H \| 18 17 dddd 2H J 61 74 87 133 \| 17 16 ddtd 2H J 27 60 88 137	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2F)cc1I	ir: 1 3 2 2 1 4 4 1 0 1 3 6 6 2 1 2 2 1 1 1 2 4 5 2 1 1 2 4 3 1 3 9 9 2 4 6 2 4 3 5 3 28 49 18 6 5 2 3 3 4 2 0 4 7 27 35 2 1 1 1 1 1 1 1 1 4 10 12 10 8 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 17 4 6 2 2 0 4 100 34 3 2 1 1 2 1 0 1 2 1 1 8 5 5 15 6 3 1 2 3 4 2 2 5 2 1 1 3 6 4 1 2 2 1 1 4 7 43 5 2 16 2 1 2 9 22 5 36 12 3 2 7 15 9 6 23 10 5 2 1 1 1 1 5 1 1 1 0 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 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 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 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 1 1 1 0 2 2 1 1 6 8 23 30 19 7 5 4 2 1 1 1 1 1 1 1 1 2 2 2 1 3 2 2 7 11 26 32 44 11 5 2 1 1 1 2 0 0 1 1 0 0 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 1 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 d 1H J 21 \| 80 80 ddq 1H J 9 19 29 \| 77 77 dd 1H J 22 79 \| 76 75 dddt 1H J 13 25 36 69 \| 73 73 dd 1H J 74 102 \| 72 72 dq 1H J 10 79 \| 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.
CN(C)[C@@H]1CC[C@@H](CNc2c(C(=O)C3CC3)cnc3ccc(Br)cc23)CC1	ir: 2 7 8 5 14 10 11 4 6 8 5 3 3 6 5 4 4 5 3 4 6 13 6 4 4 5 4 6 5 6 6 8 7 7 7 6 19 13 14 14 14 22 27 19 10 10 9 10 16 13 18 7 21 27 30 83 100 99 13 5 4 2 4 2 5 6 6 6 8 12 7 6 5 6 4 4 7 5 16 16 5 6 5 5 4 8 10 20 16 10 4 6 16 12 27 17 26 12 20 22 6 6 4 10 6 6 5 13 7 8 3 4 2 5 5 16 30 7 7 15 9 9 7 9 7 3 12 23 20 10 8 10 11 6 4 4 4 9 10 15 35 10 15 8 10 11 8 18 40 39 31 26 51 37 13 29 13 4 3 3 55 93 7 5 2 8 27 0 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 2 1 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 5 6 5 4 5 3 4 4 14 8 11 9 15 25 47 23 22 8 13 5 3 6 2 3 2 3 2 3 3 3 2 6 6 5 6 10 21 25 57 74 35 23 13 9 8 5 5 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 1 1 2 2 1 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 1 2 2 1 2 2 2 1 2 2 2 2 2 2; 1HNMR: 92 92 s 1H \| 82 81 d 1H J 27 \| 80 80 t 1H J 60 \| 79 79 d 1H J 84 \| 77 77 dd 1H J 25 83 \| 34 33 ddd 1H J 53 60 125 \| 32 31 ddd 1H J 53 60 125 \| 29 28 p 1H J 60 \| 26 25 m 1H \| 23 22 d 6H J 16 \| 18 16 m 5H \| 15 14 ddt 2H J 49 77 125 \| 14 13 dtd 2H J 48 73 136 \| 12 11 m 2H \| 9 9 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc(F)cc1	ir: 3 2 5 4 1 4 5 10 5 10 10 7 9 8 2 7 6 5 4 13 12 5 6 4 2 2 2 3 4 2 2 3 2 2 2 2 1 1 2 2 9 9 1 2 4 2 8 7 4 1 1 1 1 3 4 7 3 1 2 1 1 0 1 2 1 2 1 2 3 2 2 3 2 1 2 1 2 4 3 6 4 9 3 2 2 10 17 10 10 6 18 12 7 7 2 2 2 3 4 3 6 9 9 3 2 2 2 2 2 2 6 3 4 2 2 1 2 2 2 2 2 3 2 5 3 3 7 2 2 2 2 1 1 1 1 1 4 11 6 12 5 1 1 1 1 1 1 3 2 1 1 5 6 3 1 23 6 3 10 3 1 6 1 0 1 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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 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 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 2 2 2 3 5 1 5 12 3 1 2 3 3 6 100 85 20 8 3 2 1 1 1 1 1 1 3 1 1 2 3 6 21 12 3 4 2 1 1 1 1 1 1 1 1 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 0 1 0 0 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 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 83 83 m 2H \| 73 72 m 2H \| 71 71 m 2H \| 67 67 d 1H J 84 \| 60 59 ddt 1H J 8 15 61 \| 54 54 d 1H J 60 \| 54 53 t 1H J 45 \| 53 52 m 1H \| 52 52 d 1H J 46 \| 47 46 tdd 1H J 7 50 60 \| 42 41 qdd 1H J 13 22 49 \| 40 39 qt 1H J 11 34 \| 38 38 dddd 1H J 18 35 46 121 \| 36 35 dddd 1H J 17 35 44 121 \| 16 16 d 3H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1cccc(Oc2ccc3nc(NC(=O)C4CC4)[nH]c3c2)c1	ir: 14 27 38 13 3 4 11 5 3 3 2 3 5 6 3 2 3 6 6 3 6 2 5 7 1 2 2 1 2 2 1 3 2 2 2 5 4 2 4 9 6 3 3 9 25 10 3 4 29 10 3 4 2 2 3 34 10 4 2 5 5 1 2 5 3 1 4 13 18 2 1 1 2 1 1 1 1 2 2 2 7 22 6 2 2 1 4 1 3 3 2 3 2 2 8 2 1 1 2 1 2 3 3 3 2 4 3 13 11 3 3 1 1 2 3 1 1 2 1 1 1 1 2 1 1 2 2 1 1 1 1 1 1 1 2 1 2 2 10 2 5 3 2 2 4 6 4 11 16 19 5 17 21 17 17 23 12 18 7 3 2 4 66 10 21 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 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 2 2 4 2 2 5 11 34 11 7 5 3 1 2 2 1 2 2 1 1 1 2 1 2 2 13 21 2 2 7 11 14 34 20 3 11 17 100 29 6 4 1 3 2 0 1 3 2 0 1 2 1 0 1 2 1 0 1 1 1 0 1 2 1 1 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 97 97 s 1H \| 96 96 s 1H \| 76 76 d 1H J 82 \| 71 70 ddd 2H J 28 51 80 \| 69 68 d 1H J 23 \| 63 63 ddd 1H J 11 20 77 \| 63 62 m 2H \| 40 39 s 2H \| 25 25 p 1H J 56 \| 12 11 m 2H \| 10 9 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNC(=O)CC[C@@H](COC(c1ccccc1)(c1ccccc1)c1ccccc1)NC	ir: 1 1 2 0 1 1 1 1 1 1 1 1 12 2 1 1 0 1 2 1 1 2 2 2 2 5 8 10 5 3 7 13 5 22 25 7 3 1 2 5 40 78 23 4 2 3 3 1 3 4 7 22 10 2 2 2 1 1 1 1 1 3 1 1 1 1 1 4 14 3 3 7 1 1 2 6 8 3 3 1 1 1 3 1 1 1 0 0 0 0 0 0 0 1 0 2 1 1 0 0 1 1 1 1 2 1 2 1 1 1 1 3 8 23 25 24 9 6 4 4 7 4 3 8 2 7 3 3 2 2 3 11 5 4 2 22 12 2 1 1 2 2 6 35 43 72 30 8 3 1 1 1 2 3 0 1 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 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 4 3 1 2 1 1 1 5 3 7 5 6 25 28 100 12 3 2 3 2 1 1 2 1 0 1 1 1 1 1 3 7 8 9 67 18 16 11 7 7 4 1 0 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; 1HNMR: 74 74 m 6H \| 73 72 m 9H \| 59 59 q 1H J 50 \| 36 36 dd 1H J 42 117 \| 34 33 dd 1H J 43 118 \| 32 31 dq 1H J 47 68 \| 30 30 d 3H J 49 \| 29 28 m 1H \| 24 24 dd 3H J 16 47 \| 24 23 dt 1H J 80 161 \| 23 22 dt 1H J 81 160 \| 19 18 dtd 1H J 64 81 145 \| 17 15 dtd 1H J 63 80 144	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(C(=O)NCC2CC2)cc1-c1ccc(C(=O)NCc2cccc(NS(C)(=O)=O)c2)cn1	ir: 3 4 9 4 13 4 3 6 16 5 2 3 1 2 1 2 2 2 4 6 5 9 22 12 3 4 4 5 9 5 6 7 8 20 3 7 10 23 25 100 48 34 5 5 10 6 6 8 6 8 9 10 12 11 40 10 4 8 4 2 2 1 1 1 1 1 2 2 43 37 20 7 2 4 3 3 3 3 3 7 2 2 2 2 1 2 10 13 20 46 14 5 6 1 3 2 1 2 6 10 18 10 19 20 15 5 2 1 2 5 1 1 3 2 4 3 8 5 10 11 18 11 11 4 4 9 5 4 3 9 3 2 2 3 4 4 51 4 4 7 30 24 14 10 44 17 14 10 8 9 35 12 8 4 18 3 5 1 1 1 2 3 13 11 1 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 1 1 1 1 1 2 2 1 2 2 2 1 1 1 2 2 17 11 15 5 12 27 47 24 20 4 5 2 1 1 1 1 1 1 1 2 2 2 2 2 2 3 4 5 12 10 17 43 28 82 23 3 1 2 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; 1HNMR: 90 90 d 1H J 20 \| 85 84 d 1H J 14 \| 81 81 dd 1H J 19 83 \| 81 80 t 1H J 57 \| 79 78 d 1H J 83 \| 78 77 dd 1H J 15 81 \| 77 76 t 1H J 53 \| 75 75 s 1H \| 74 73 dq 1H J 10 82 \| 73 72 m 1H \| 72 72 dt 1H J 17 81 \| 71 71 dtt 2H J 9 19 61 \| 45 44 dt 2H J 8 57 \| 33 32 dd 2H J 39 54 \| 29 29 s 2H \| 25 24 d 3H J 11 \| 11 10 pt 1H J 38 57 \| 5 4 m 2H \| 3 2 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(OC)c(C(=O)c2oc3ccccc3c2O)c1	ir: 1 1 2 1 0 1 1 1 1 1 1 1 1 1 2 2 2 3 5 6 5 4 12 7 3 1 1 2 2 1 2 1 1 2 3 3 1 1 2 1 1 4 22 19 11 8 2 1 2 1 1 1 2 6 2 1 1 1 1 1 1 1 3 2 4 5 1 2 2 2 2 1 2 3 2 2 1 2 3 1 2 2 2 3 2 2 2 4 3 5 9 2 1 1 1 1 1 1 1 14 12 22 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 1 3 2 1 1 1 1 0 1 1 2 1 1 1 3 7 3 1 2 2 4 7 6 9 9 19 4 2 3 1 0 1 1 2 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 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 1 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 1 1 1 0 1 1 1 0 1 1 2 0 4 4 6 24 12 4 2 6 9 100 35 7 3 3 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 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 1 0 0 1 1 0 0 1 0 0 0 1; 1HNMR: 78 77 dt 1H J 8 93 \| 74 74 m 2H \| 73 72 m 1H \| 72 72 d 1H J 26 \| 71 70 dd 1H J 27 87 \| 70 70 d 1H J 88 \| 38 38 s 3H \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1ccc(-c2cncc(NS(=O)(=O)Cc3ccc(F)cc3)c2)cc1Cl	ir: 10 3 2 5 17 7 8 37 10 3 1 9 9 11 16 18 13 10 16 9 3 4 2 12 19 24 17 13 2 5 6 6 10 10 18 14 6 6 4 3 6 3 3 3 5 9 4 2 2 1 1 2 4 2 8 78 57 5 8 4 3 1 2 6 4 5 8 10 25 18 3 3 2 1 2 1 1 1 2 4 6 5 2 2 8 21 18 43 9 6 7 1 2 3 1 12 8 3 4 5 8 22 25 9 1 1 2 4 4 4 4 4 71 41 22 3 3 5 3 5 3 4 11 13 6 7 4 2 2 3 3 2 5 6 15 7 4 2 4 9 2 1 2 1 1 4 1 7 17 9 5 16 8 6 4 1 8 1 1 2 5 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 2 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 0 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 1 0 1 1 1 0 1 7 12 2 1 1 1 1 1 4 5 12 24 90 26 3 3 4 3 1 2 3 1 1 1 2 0 1 1 2 1 0 2 3 2 2 4 9 20 22 100 37 6 3 2 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 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 0 0; 1HNMR: 85 85 t 1H J 16 \| 84 84 t 1H J 17 \| 84 83 s 1H \| 79 79 t 1H J 17 \| 77 77 d 1H J 69 \| 77 76 d 1H J 22 \| 75 75 dd 1H J 22 68 \| 75 74 ddt 2H J 9 35 79 \| 71 70 m 2H \| 44 44 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OCCc1c[nH]c2cc(F)cc(OCc3ccccc3)c12	ir: 2 3 1 3 2 4 2 2 4 3 3 2 5 4 2 2 3 6 1 1 1 2 1 3 3 19 13 14 15 3 4 2 1 2 2 1 1 3 1 19 31 6 2 1 1 1 2 1 1 0 1 0 1 1 3 1 1 0 1 0 1 3 2 7 5 18 13 14 7 4 1 1 1 2 2 2 1 2 3 1 1 1 1 1 3 1 7 10 8 33 16 8 8 8 6 2 3 15 6 3 1 1 1 3 6 1 1 3 7 2 1 1 1 1 3 5 2 1 5 2 0 2 2 1 3 2 1 2 1 2 1 1 1 1 2 3 1 0 1 2 3 24 8 2 2 2 8 1 1 1 2 2 5 3 1 0 0 43 4 1 1 1 24 2 1 1 0 1 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 1 1 1 1 1 1 1 1 1 1 0 1 0 0 0 1 1 1 1 1 1 0 1 3 2 0 6 8 16 74 13 8 14 4 4 10 24 100 8 0 2 2 0 1 1 1 0 1 1 1 0 1 1 2 5 25 18 1 1 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 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; 1HNMR: 90 90 d 1H J 71 \| 74 73 m 4H \| 74 73 m 1H \| 69 69 dt 1H J 9 70 \| 69 69 dd 1H J 21 122 \| 66 65 dd 1H J 21 122 \| 51 51 t 2H J 8 \| 39 38 q 2H J 57 \| 30 30 td 2H J 9 57 \| 24 24 t 1H J 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)N1C2C=C(N3CCCC3)CC1CCC2	ir: 10 26 21 8 4 5 5 4 11 15 10 7 6 2 3 5 5 4 9 2 3 2 2 3 6 3 2 4 4 2 7 2 1 2 1 2 4 2 2 2 2 1 2 2 3 3 2 5 2 3 2 0 16 2 3 2 9 5 4 31 4 7 2 6 8 26 5 3 39 6 5 4 4 6 7 4 9 2 2 2 2 2 5 2 2 3 4 5 6 6 12 13 12 13 5 5 2 2 3 2 4 5 8 5 7 12 26 14 19 5 3 5 13 17 14 8 23 14 26 19 6 9 8 9 5 3 5 4 8 7 2 3 7 6 14 14 16 16 6 5 2 2 2 2 2 2 2 1 1 5 32 100 5 1 1 2 2 4 4 46 23 1 2 3 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 1 1 1 2 1 2 2 2 1 2 2 2 4 3 3 2 6 6 9 6 13 5 6 4 8 9 10 38 12 17 9 6 2 2 2 2 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 56 56 m 1H \| 47 46 qt 1H J 10 57 \| 42 41 q 2H J 66 \| 41 40 p 1H J 56 \| 33 32 dq 4H J 20 45 \| 23 23 ddt 1H J 10 55 136 \| 21 20 m 2H \| 20 19 m 3H \| 19 18 m 2H \| 18 15 m 4H \| 12 12 t 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCNC(=O)Nc1cn2ccc(-c3nc(C)nn3C)cc2n1	ir: 1 0 0 2 4 1 0 0 1 1 8 8 1 4 3 1 1 1 1 2 7 16 2 2 1 1 0 2 2 3 2 2 5 1 1 1 1 1 0 1 1 0 2 3 4 12 12 9 13 5 2 1 2 2 1 1 1 1 1 1 3 1 1 1 1 2 21 32 2 2 2 2 1 1 1 3 7 3 1 1 0 0 1 0 0 0 0 1 1 0 1 0 0 0 1 1 1 0 1 1 0 6 1 0 1 0 1 1 1 6 1 1 3 2 2 3 2 2 1 1 1 2 2 1 1 1 1 1 2 3 1 1 3 4 2 3 2 6 16 12 2 1 6 5 0 22 13 27 4 0 16 13 6 0 1 1 1 1 3 100 10 1 1 1 1 1 1 0 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 1 1 1 1 0 0 1 1 0 1 1 1 1 2 3 3 2 2 2 4 4 21 4 9 2 1 0 1 1 1 1 0 1 1 1 1 2 3 0 3 3 9 23 9 12 3 1 2 1 1 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 90 90 d 1H J 75 \| 89 89 s 1H \| 79 78 dd 1H J 13 73 \| 78 78 m 2H \| 65 64 t 1H J 38 \| 40 39 s 3H \| 33 32 qd 2H J 37 61 \| 25 24 s 3H \| 12 12 t 3H J 61	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(O)c1ccc2c(c1)CCC(=O)N2	ir: 3 3 10 4 7 5 5 5 3 3 5 4 4 10 6 4 4 9 7 4 2 6 4 2 2 4 4 5 8 18 6 14 6 23 12 18 17 13 6 4 4 4 4 4 5 7 4 3 3 4 4 4 4 10 9 9 11 6 3 5 6 4 6 4 3 6 4 2 4 3 3 2 4 4 2 2 3 3 2 2 3 3 4 6 5 15 4 25 31 13 11 8 8 7 3 4 5 5 9 9 6 3 2 2 4 3 2 3 5 3 1 2 3 3 6 5 12 5 6 11 6 6 3 5 7 4 5 4 4 8 3 12 6 3 4 2 2 2 1 2 2 2 3 2 4 2 2 4 4 3 3 2 4 5 56 76 18 2 3 4 3 0 10 6 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 2 1 2 2 2 2 3 3 4 3 4 3 3 3 5 3 5 3 4 6 4 7 7 8 6 4 6 7 14 9 12 35 11 13 22 6 5 5 9 95 57 100 63 4 5 5 3 3 2 4 4 3 4 9 8 12 14 10 20 11 7 6 7 5 6 6 3 4 2 3 2 2 2 3 3 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 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2; 1HNMR: 94 94 s 1H \| 72 72 dt 1H J 8 79 \| 71 71 p 1H J 9 \| 70 70 d 1H J 79 \| 49 48 m 1H \| 30 29 m 2H \| 26 25 m 2H \| 24 24 d 1H J 49 \| 15 14 d 3H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1N(c2c(Cl)cccc2Cl)Cc2cnc(Nc3ccccc3)nc2N1c1ccccc1	ir: 18 17 17 17 17 17 17 17 17 17 16 17 17 17 17 17 17 17 17 17 17 17 17 18 18 24 21 17 19 18 20 18 20 17 19 22 26 34 33 31 32 36 49 20 20 19 21 25 18 17 17 17 19 17 17 17 17 17 19 17 17 17 18 17 17 18 17 18 21 20 18 17 17 17 17 20 18 17 19 17 17 17 17 17 20 17 16 17 18 17 19 16 18 20 16 17 17 18 18 18 17 17 16 19 21 17 17 17 17 17 16 16 17 17 18 16 17 16 16 17 17 16 16 17 17 16 16 19 17 17 18 17 20 17 17 24 17 18 18 20 18 17 17 20 20 30 18 19 34 18 24 21 20 42 24 32 19 5 100 0 22 21 43 15 17 20 17 14 16 18 16 15 16 18 16 15 16 17 16 15 17 17 16 16 17 17 16 16 17 17 16 16 17 17 16 16 17 17 16 16 17 17 16 16 17 17 16 16 17 17 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 17 17 16 16 16 17 16 16 17 17 16 16 17 16 16 16 17 17 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 17 16 16 17 16 17 17 18 19 20 17 81 28 18 18 19 17 16 17 17 16 16 17 17 16 16 16 17 17 16 17 17 17 18 18 18 27 88 19 18 17 16 17 17 17 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 17 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16 16; 1HNMR: 89 89 s 1H \| 81 81 t 1H J 9 \| 78 77 m 2H \| 75 75 m 2H \| 74 72 m 7H \| 72 71 dd 1H J 80 90 \| 69 68 tt 1H J 11 69 \| 51 50 d 2H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1Nc2ccccc2Nc2nc(-c3ccccc3)ncc21	ir: 7 7 6 9 12 20 9 8 20 11 9 8 8 9 8 9 14 8 7 8 13 9 16 52 15 18 47 6 8 17 25 14 37 9 12 32 10 17 11 10 91 44 28 56 12 35 43 33 10 8 7 8 7 6 8 23 21 6 7 8 6 6 7 7 7 6 7 7 8 10 7 6 7 16 13 8 7 7 16 8 7 9 7 12 20 10 8 6 6 7 7 7 7 10 15 15 8 8 7 8 11 43 15 7 7 7 6 7 7 7 14 9 7 7 13 8 6 7 7 7 7 8 8 16 17 14 10 24 16 8 17 8 7 12 8 9 10 7 7 12 23 36 14 19 34 52 38 77 11 0 23 7 6 12 90 14 86 24 45 77 18 17 24 7 7 7 7 6 6 7 6 6 6 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 7 6 6 6 6 6 6 6 6 6 6 6 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 7 6 6 6 7 7 7 9 9 9 8 28 100 30 19 10 10 9 8 7 7 8 6 7 8 7 7 7 7 7 6 8 8 10 11 22 19 69 68 50 29 11 11 9 10 8 8 7 6 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6; 1HNMR: 100 99 s 1H \| 98 98 s 1H \| 92 92 s 1H \| 83 83 dt 2H J 13 91 \| 76 75 m 4H \| 72 72 m 2H \| 71 71 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CN[C@@H]1CCCN2c3cc(Cl)ccc3N(C)c3ccccc3[C@H]12	ir: 11 6 5 4 4 3 4 4 3 7 2 18 4 2 2 5 6 3 6 4 3 4 8 3 7 25 9 7 10 5 2 2 4 1 2 11 2 5 4 10 13 14 53 45 7 11 17 9 5 11 5 10 19 30 27 31 15 19 8 0 3 8 4 4 29 8 28 6 19 10 9 8 14 32 12 18 13 3 2 3 3 1 2 3 7 30 2 5 3 3 3 7 4 9 16 5 4 3 4 4 17 10 9 3 4 16 12 5 5 9 19 30 10 35 18 10 8 7 4 4 5 11 1 7 9 10 6 12 4 25 5 9 22 25 6 6 5 5 8 6 3 4 3 12 25 17 23 3 9 53 13 8 4 4 7 16 4 2 2 1 5 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 1 2 4 4 5 3 3 4 4 3 4 11 35 7 22 100 35 14 7 3 2 3 3 1 2 2 2 2 3 3 3 3 4 10 24 75 27 13 7 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 74 73 ddd 1H J 7 14 88 \| 73 72 m 2H \| 72 71 ddd 1H J 15 80 91 \| 70 69 m 2H \| 69 68 d 1H J 21 \| 45 45 dd 1H J 7 48 \| 42 41 q 2H J 66 \| 38 37 m 1H \| 36 35 dd 1H J 58 169 \| 35 35 s 2H \| 35 34 m 2H \| 34 33 dddd 1H J 31 48 59 80 \| 33 32 dt 1H J 58 82 \| 22 21 m 1H \| 19 17 m 3H \| 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.
CC(C)(c1nc2cccnc2[nH]1)[C@@H]1c2ccc(Cl)nc2Oc2c(F)cccc21	ir: 2 3 1 1 2 1 1 2 2 2 1 6 3 3 11 3 11 3 1 2 2 4 6 3 2 4 4 3 23 3 6 3 2 2 8 3 8 17 100 15 6 29 11 6 6 1 1 3 17 10 2 10 3 2 11 14 12 1 3 4 5 13 29 7 4 2 2 3 1 0 2 3 1 1 2 2 1 2 3 3 1 1 3 3 20 4 2 3 3 4 3 6 2 4 6 2 3 17 10 3 2 2 2 2 2 2 3 1 1 1 2 2 2 2 2 1 1 2 3 3 3 2 2 2 2 4 4 3 4 4 5 3 4 3 9 23 10 27 34 3 6 14 10 5 8 19 7 2 5 9 4 12 84 9 8 7 3 4 7 23 6 3 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 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 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 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 3 4 20 5 6 36 27 11 6 9 9 4 3 3 2 1 2 2 2 1 2 2 1 2 3 2 6 4 3 9 23 12 41 11 5 3 6 3 2 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 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 85 84 dd 1H J 22 44 \| 79 79 dd 1H J 20 71 \| 76 75 m 1H \| 74 73 dd 1H J 44 71 \| 72 71 ddd 1H J 13 79 100 \| 71 71 ddd 1H J 52 67 79 \| 69 69 dt 1H J 10 68 \| 69 68 d 1H J 77 \| 45 45 dtp 1H J 8 14 22 \| 18 18 d 3H J 15 \| 18 17 d 3H J 15	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Ic1ccccc1N1CCNCC1	ir: 1 1 1 1 1 1 1 4 3 2 1 1 1 1 0 5 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 1 4 2 1 45 17 2 2 1 1 2 2 2 4 5 100 16 18 2 2 5 18 8 2 3 3 2 1 2 8 1 1 2 9 3 1 1 2 1 1 1 5 1 1 1 2 3 0 2 3 16 2 1 1 1 1 2 4 1 13 3 1 1 1 2 2 1 1 2 3 1 30 43 7 9 4 4 8 7 10 2 2 2 1 1 1 0 1 1 1 2 17 3 4 1 3 1 1 3 1 1 1 4 11 5 1 1 2 3 29 8 0 0 1 1 0 3 1 1 0 3 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 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 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 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 1 2 3 2 2 2 1 0 1 2 2 1 10 5 14 48 11 2 2 2 1 1 1 1 1 1 1 1 1 2 3 5 4 4 56 49 3 2 2 3 2 1 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 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 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0; 1HNMR: 78 77 dd 1H J 14 79 \| 73 72 td 1H J 14 72 \| 70 69 dd 1H J 14 71 \| 69 69 td 1H J 15 75 \| 33 32 m 4H \| 31 30 m 4H \| 19 19 p 1H J 33	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOP(=O)(Cc1cc(F)c(CC=C(C)CCC=C(C)C)c(F)c1)OCC	ir: 8 6 6 4 6 5 5 5 7 6 5 8 9 9 25 9 6 6 5 5 5 5 8 13 6 7 5 5 5 4 4 5 6 11 6 7 6 6 8 13 6 4 7 9 9 4 11 11 8 5 5 8 6 4 4 6 4 10 7 16 10 7 6 11 6 11 35 24 50 31 20 17 16 19 16 14 20 81 15 22 84 40 7 5 5 4 4 4 4 4 4 4 5 8 10 23 16 17 10 5 5 4 4 4 4 4 4 4 6 9 5 6 5 9 13 14 18 23 9 21 7 8 7 10 5 6 5 5 13 25 4 5 7 5 4 6 5 4 7 6 5 4 4 5 4 3 5 5 4 3 3 5 4 3 7 9 5 10 4 14 100 18 6 0 3 6 4 2 4 5 4 3 4 5 4 3 4 5 4 4 4 4 4 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 6 4 5 6 5 7 7 8 8 5 6 8 9 25 29 25 37 45 27 11 5 5 4 4 5 5 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4; 1HNMR: 70 69 dq 2H J 8 113 \| 54 53 tq 1H J 13 88 \| 51 50 tdq 1H J 13 25 83 \| 43 42 dq 4H J 72 84 \| 39 38 dt 2H J 8 119 \| 34 33 dddt 2H J 10 51 62 83 \| 22 20 m 4H \| 18 17 q 3H J 11 \| 17 16 hept 3H J 12 \| 16 16 hept 3H J 13 \| 14 13 td 6H J 7 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCOCCCOCCCCCO	ir: 2 11 5 6 7 5 2 7 4 7 3 9 2 3 4 4 6 4 1 4 2 2 1 1 1 1 2 1 1 1 1 2 2 1 1 2 3 3 7 11 4 5 2 2 2 3 1 2 2 2 2 1 2 2 3 2 4 2 4 9 9 4 5 7 6 11 9 13 14 15 19 18 12 20 25 6 4 5 7 6 8 13 14 12 27 33 25 42 80 83 67 49 32 10 20 17 7 5 4 5 1 3 3 2 7 8 14 6 18 16 10 7 6 6 5 11 4 11 23 18 18 7 5 9 6 4 4 3 2 4 3 7 6 4 1 3 2 1 1 0 0 0 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 1 0 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 1 1 1 1 2 1 1 2 5 9 11 19 11 12 18 24 20 14 10 12 9 10 23 34 40 17 20 13 5 6 7 12 13 32 61 100 52 28 16 7 5 8 6 4 5 2 4 5 3 8 5 5 10 7 4 3 6 6 4 4 3 3 3 5 6 5 2 2 2 1 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; 1HNMR: 36 35 q 2H J 58 \| 35 34 m 6H \| 34 34 t 2H J 61 \| 27 26 t 1H J 58 \| 19 18 p 2H J 67 \| 16 16 m 2H \| 16 15 dddt 5H J 12 23 47 84 \| 15 15 m 1H \| 15 14 dq 2H J 70 81 \| 14 12 m 4H \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
OCCc1ccc(-n2c(-c3cc[nH]n3)nc3cc(C(F)(F)F)c(Cl)cc32)cc1	ir: 2 5 5 3 1 4 4 3 4 2 4 2 3 10 6 7 2 3 6 3 4 4 3 4 7 4 15 4 3 7 5 5 4 2 4 3 2 1 4 2 3 7 7 5 11 6 3 5 3 4 1 2 6 9 7 24 25 8 1 1 3 3 5 2 13 33 29 54 20 14 2 3 1 1 6 11 9 6 4 6 5 8 35 17 18 20 29 7 24 11 9 14 14 13 11 9 2 7 17 68 8 1 2 8 60 8 23 4 4 3 5 4 2 2 3 2 13 4 2 11 4 8 5 10 32 36 25 29 45 11 29 16 14 3 4 10 9 4 3 7 8 3 3 8 1 1 1 3 7 0 1 37 13 2 15 2 2 0 2 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 1 1 0 1 1 0 0 0 0 0 0 1 0 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 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 1 0 0 1 0 0 1 1 1 0 1 0 1 0 0 0 1 1 0 1 1 0 1 1 2 14 12 10 12 26 100 29 11 9 9 8 11 23 37 21 22 17 34 33 31 13 11 2 2 1 1 0 1 1 0 1 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 84 84 s 1H \| 80 79 q 1H J 21 \| 75 75 dd 1H J 20 31 \| 74 74 m 2H \| 72 72 dp 2H J 9 75 \| 68 67 d 1H J 20 \| 38 38 q 2H J 57 \| 28 28 tt 2H J 9 57 \| 18 17 t 1H J 60	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCc1nc(C)nn1-c1cc([C@@H]2C[C@H]2c2nc3ccccc3n2C)nc(C)n1	ir: 3 2 2 1 1 1 1 1 3 2 1 1 3 2 2 2 2 2 1 2 1 2 1 3 1 1 1 1 1 0 1 3 1 1 4 2 2 3 4 5 9 24 100 29 18 9 7 7 2 3 2 1 2 3 3 6 3 3 2 1 1 2 2 1 2 3 1 4 9 17 7 3 3 4 3 3 3 3 6 1 1 2 4 3 9 2 1 4 11 11 1 3 2 2 1 1 1 2 2 1 2 4 2 3 4 6 27 10 3 2 2 6 4 6 8 4 6 2 6 9 8 4 1 4 11 10 3 12 22 6 6 2 1 5 2 1 1 9 8 4 2 5 6 5 2 2 2 8 7 1 8 10 6 2 1 2 1 0 1 5 2 1 1 2 2 0 0 1 1 0 1 2 10 5 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 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 1 1 5 12 2 3 2 2 3 3 2 5 4 6 8 8 18 36 23 37 61 34 9 9 5 4 3 3 1 1 2 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 76 76 m 1H \| 74 73 m 2H \| 72 72 td 1H J 18 65 \| 69 68 d 1H J 8 \| 47 47 s 2H \| 38 37 s 3H \| 36 35 dt 1H J 71 82 \| 34 34 s 3H \| 32 31 ddd 1H J 63 70 77 \| 26 26 s 3H \| 25 24 s 3H \| 19 18 ddd 1H J 64 71 103 \| 17 16 ddd 1H J 74 81 103	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNN=C(C)C(C)=NO	ir: 16 18 13 33 17 21 48 22 19 12 30 30 12 7 6 6 10 5 7 3 2 5 7 4 2 2 3 3 6 3 1 1 1 1 1 1 1 1 1 2 1 3 2 4 1 3 2 1 1 1 1 2 1 1 1 2 2 1 2 1 1 1 2 2 2 2 4 3 6 6 3 4 3 2 5 3 4 4 4 4 10 12 9 12 7 1 3 1 0 1 2 1 0 1 4 3 1 12 7 49 19 7 1 3 4 3 1 1 1 1 1 1 2 1 2 3 5 11 8 2 1 5 7 6 6 12 5 5 5 12 7 2 7 9 12 12 7 2 1 1 1 1 2 3 10 8 1 3 2 0 1 2 1 2 5 14 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 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 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 3 1 1 1 1 1 0 1 1 1 1 1 2 3 3 5 3 1 0 2 2 2 2 3 8 21 100 79 73 11 4 3 2 3 3 3 3 5 9 10 13 35 25 18 21 7 8 8 4 7 4 1 1 1 1 2 1 1 1 1 1 1 1 1 0 1 0 1 1 0 1 1 0 1 1 1 1 1 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 69 68 q 1H J 56 \| 29 28 d 4H J 55 \| 20 20 s 3H \| 20 20 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@]2(O)CC#N	ir: 18 17 17 21 40 26 22 18 12 5 5 10 8 11 17 10 19 22 17 15 22 9 8 9 14 8 9 7 7 3 4 8 7 4 4 10 13 7 3 11 12 3 9 14 10 4 6 14 9 11 7 16 17 10 8 10 9 5 7 17 16 58 23 8 6 10 24 18 6 2 11 14 11 39 64 58 64 78 49 36 18 53 32 19 7 6 13 27 89 26 58 57 28 26 18 16 12 7 9 10 10 8 23 21 23 24 49 18 19 33 29 25 29 15 23 12 6 26 49 38 21 8 15 16 21 26 12 16 16 14 20 10 8 7 8 6 6 13 15 100 34 9 7 3 3 5 5 3 3 5 6 6 8 19 84 5 9 5 4 4 6 3 69 26 4 8 4 0 3 7 3 0 3 6 3 1 4 6 3 14 7 6 3 1 4 5 3 1 4 5 3 1 4 5 2 2 5 5 2 2 5 5 2 2 5 4 2 3 5 4 1 3 5 4 2 3 5 4 1 3 6 4 1 3 5 3 1 4 6 3 1 3 6 4 1 4 6 3 1 4 5 3 2 4 5 3 2 5 5 3 2 4 5 3 2 5 5 2 2 5 5 3 4 6 5 5 6 6 5 3 6 11 9 12 39 12 24 14 11 14 21 19 23 21 48 73 42 18 9 4 7 9 5 4 49 93 15 3 6 8 4 2 5 5 3 2 5 5 3 2 5 5 3 2 4 4 2 3 5 5 2 2 5 5 2 3 5 4 2 3 5 4 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 4 5 3 2 4 5 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 3 5 4 2 3 5 3 1 3 5 3 1 3 5 3 1; 1HNMR: 57 57 p 1H J 9 \| 37 36 s 1H \| 29 28 m 3H \| 26 26 d 1H J 112 \| 26 24 m 4H \| 23 23 dddt 1H J 9 33 60 81 \| 23 21 m 2H \| 20 18 dtdd 3H J 27 55 71 138 \| 18 16 m 3H \| 15 14 dtd 1H J 56 75 133 \| 14 12 m 2H \| 11 10 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(COc2cc(Cl)c(C=O)c(Cl)c2)cc1	ir: 1 2 3 2 1 3 1 4 3 2 3 2 3 4 2 2 1 6 5 2 3 2 3 3 3 2 2 5 2 2 2 2 2 2 2 2 2 6 2 1 1 1 2 4 2 2 1 3 3 3 4 7 14 40 21 12 9 15 13 12 7 12 5 10 6 12 27 21 17 25 7 3 3 2 1 0 1 2 1 1 2 2 1 1 2 2 4 6 8 4 1 2 3 2 2 3 8 23 3 1 3 2 1 2 4 4 1 4 5 13 5 3 2 1 1 1 2 2 2 2 3 2 2 2 3 3 2 4 3 3 4 1 2 1 1 1 1 1 1 1 1 1 1 1 4 2 2 10 10 3 3 4 5 5 6 19 20 8 3 1 19 41 7 5 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 1 1 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 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 3 1 1 2 2 0 1 2 2 0 1 3 2 2 4 15 33 100 23 2 2 2 2 1 1 2 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; 1HNMR: 73 73 dq 2H J 9 83 \| 70 70 s 2H \| 69 69 m 2H \| 51 51 t 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.
O=C1CCCc2cccc(Br)c21	ir: 0 12 22 11 2 13 22 11 4 13 21 10 4 14 20 12 8 15 53 28 6 21 22 33 8 22 17 10 8 19 24 7 7 17 15 6 9 17 14 5 10 19 14 8 29 95 29 51 94 34 14 2 12 27 13 0 11 23 11 0 20 36 11 1 13 20 11 3 14 28 12 5 14 19 9 4 14 18 7 5 16 21 7 5 16 18 7 7 18 32 24 14 20 15 6 29 42 17 4 11 25 18 6 10 21 15 4 11 20 12 5 15 34 20 8 21 30 17 6 32 29 17 8 13 21 12 4 15 20 14 6 15 23 40 42 16 18 15 15 40 51 11 24 37 19 8 9 17 15 55 30 22 15 18 17 17 34 32 12 19 13 4 10 19 12 3 10 20 11 2 11 20 11 3 12 19 10 3 12 19 10 4 13 18 9 5 13 17 9 5 14 17 8 6 14 16 7 6 15 15 7 7 16 15 6 8 16 14 6 8 17 13 5 9 17 13 4 9 18 12 4 10 18 12 3 11 19 11 3 11 19 11 3 12 18 10 4 12 18 10 5 13 17 9 5 13 16 8 6 14 16 8 6 14 15 7 7 15 15 7 8 16 14 6 8 17 14 6 9 17 14 6 11 20 19 9 14 20 14 7 14 18 17 23 70 26 45 92 100 30 15 7 15 18 11 6 13 17 10 6 13 16 9 6 14 16 9 7 14 15 8 7 14 14 7 8 15 14 7 8 15 13 7 9 16 13 6 9 16 13 6 10 17 12 5 10 17 12 5 11 17 11 4 11 17 11 5 12 17 10 5 12 16 10 6 12 16 9 6 13 15 9 7 13 15 8 7 14 14 8 8 14 14 8 8 15 14 7 9 15 13 7 9 15 13 6 10 16 12 6 10 16 12 6 10 16 11 5 11 17; 1HNMR: 76 75 dd 1H J 13 82 \| 73 72 t 1H J 81 \| 72 71 dq 1H J 9 79 \| 30 29 m 2H \| 29 28 m 2H \| 21 20 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)Oc1cc(OCCc2ccsc2)cc(C(=O)Nc2ccc(Br)cn2)c1	ir: 2 2 3 4 3 2 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 3 0 4 6 3 2 3 2 3 3 6 5 2 1 3 4 3 7 32 24 13 4 3 5 3 4 1 2 2 9 25 9 9 2 4 3 1 1 3 1 1 2 3 11 6 7 11 4 7 1 1 2 1 2 4 1 2 4 4 3 1 2 2 1 2 8 12 1 1 2 2 6 9 16 2 2 1 1 1 1 0 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 5 2 1 1 1 1 1 1 2 2 3 3 4 4 6 10 3 1 1 0 1 1 1 0 2 6 20 100 17 17 5 43 10 11 14 2 2 1 1 2 21 4 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 10 3 12 29 16 21 13 10 5 2 3 2 1 2 1 1 1 1 1 1 2 1 2 3 3 4 4 11 26 25 8 2 3 2 1 1 0 0 1 1 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; 1HNMR: 92 92 s 1H \| 83 83 d 1H J 19 \| 79 79 dd 1H J 20 81 \| 77 77 d 1H J 81 \| 72 72 dd 1H J 17 52 \| 71 71 dt 2H J 22 90 \| 70 70 tt 1H J 9 18 \| 69 68 ddt 1H J 9 18 53 \| 66 66 t 1H J 23 \| 47 46 hept 1H J 58 \| 42 41 t 2H J 54 \| 28 28 tt 2H J 8 53 \| 13 13 d 6H J 57	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCc1nc(Cl)c(CO)n1Cc1ccccc1Cl	ir: 1 2 3 8 3 4 4 2 5 2 3 2 2 6 9 5 12 11 4 3 2 1 1 4 3 1 1 1 1 1 1 2 2 1 1 5 4 15 6 32 47 100 46 16 7 11 10 5 4 4 7 6 16 6 6 1 2 5 2 12 3 4 3 1 3 7 2 3 13 6 2 4 7 8 11 4 3 2 3 6 5 4 5 9 13 17 22 47 38 15 41 9 5 6 5 9 6 6 3 12 12 3 5 5 5 15 12 31 42 25 39 7 7 8 9 12 5 10 24 42 22 20 7 9 6 4 4 4 2 10 8 6 3 0 1 10 56 10 3 2 3 41 19 6 5 2 3 11 16 2 2 2 2 1 2 2 1 0 2 2 1 0 1 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 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 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 2 2 2 1 2 2 3 2 5 8 15 8 13 15 13 12 13 12 14 10 8 15 36 64 34 32 39 42 20 12 6 3 3 3 4 4 1 3 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 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 74 73 m 1H \| 73 72 m 3H \| 53 52 d 2H J 7 \| 47 47 d 2H J 62 \| 36 35 t 1H J 62 \| 27 26 t 2H J 70 \| 17 16 p 2H J 67 \| 15 14 m 2H \| 10 9 t 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(Cc2cnc(NC(=O)C(C)(C)C)nc2NC(=O)C(C)(C)C)c(C=O)c(O)c1OC	ir: 1 1 1 1 1 3 4 4 3 10 19 12 12 3 4 7 3 5 11 4 3 3 4 2 3 1 3 3 2 1 1 2 3 5 25 17 12 16 6 4 2 1 1 1 1 2 1 4 0 0 1 2 1 1 1 1 2 0 2 2 2 4 3 5 3 1 1 3 6 6 4 6 1 1 3 1 1 1 1 1 1 1 2 4 3 2 1 5 13 1 2 2 1 1 2 1 2 2 1 1 2 3 1 1 1 1 1 1 1 2 2 2 2 0 1 2 1 1 2 3 3 1 2 1 4 3 2 1 1 4 2 3 1 1 1 0 0 1 1 1 3 14 5 8 8 22 47 12 15 100 1 8 4 7 1 2 2 1 21 2 1 1 1 2 2 1 1 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 0 0 0 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 0 1 0 1 1 0 1 1 2 2 8 3 2 9 3 1 0 0 0 0 1 5 19 6 1 2 1 2 2 2 2 1 2 1 2 5 12 57 20 14 6 4 2 2 1 1 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 95 95 s 1H \| 93 93 s 1H \| 83 82 d 1H J 9 \| 67 67 t 1H J 9 \| 39 39 m 6H \| 39 38 s 3H \| 12 11 s 9H \| 11 11 s 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1c(Cl)n(Cc2ccccc2)c2c(=O)n(Cc3nccc4ccccc34)cnc12	ir: 4 4 3 3 11 8 7 5 7 11 15 16 7 20 8 20 11 17 6 5 3 17 40 6 18 15 6 4 3 3 7 27 17 10 10 3 12 5 10 17 26 35 9 2 15 17 8 17 45 14 6 13 5 6 5 22 5 3 4 6 3 3 3 2 3 2 4 4 13 12 6 4 3 4 3 4 11 33 14 8 3 4 2 8 8 11 3 2 3 9 5 8 5 5 4 9 6 11 9 13 8 4 1 3 6 19 7 15 4 24 9 69 12 3 0 4 16 4 10 6 10 9 6 14 16 8 2 3 3 3 2 6 9 5 28 31 6 11 12 3 3 21 24 24 48 7 7 5 12 52 3 6 7 5 88 10 13 4 3 7 15 41 7 4 3 4 23 2 3 2 2 2 2 2 2 3 2 2 2 2 2 3 2 16 2 1 2 2 2 1 2 2 1 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 4 4 4 4 4 3 3 3 3 8 9 18 29 69 100 26 9 4 5 4 4 4 3 3 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2; 1HNMR: 87 87 d 1H J 9 \| 85 84 d 1H J 46 \| 81 80 dd 1H J 16 86 \| 78 78 dt 1H J 15 82 \| 77 76 dd 1H J 12 47 \| 76 75 ddd 1H J 12 68 81 \| 75 74 ddd 1H J 13 72 85 \| 74 72 m 6H \| 56 56 d 2H J 8 \| 53 53 d 2H J 10	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC(=O)c1cn(Cc2cccc(F)c2F)cn1	ir: 2 2 2 2 2 5 14 13 10 14 5 6 10 10 10 5 5 3 3 1 2 2 2 2 1 3 4 13 6 7 4 1 1 2 2 1 6 11 6 9 15 6 7 12 8 3 13 10 27 17 3 1 2 2 2 1 2 2 1 1 2 3 10 6 3 2 1 1 2 2 1 1 1 2 5 5 2 3 1 4 7 15 21 6 2 4 8 13 4 4 2 2 7 7 12 15 10 4 1 6 13 13 7 2 2 2 2 4 8 4 4 2 4 3 1 2 5 7 6 4 5 4 5 5 6 5 2 4 4 5 2 2 3 2 5 3 3 4 3 25 32 2 2 2 2 2 2 1 1 2 1 1 2 5 4 85 37 8 2 4 2 0 2 3 1 0 1 3 17 4 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 2 1 1 3 4 4 5 7 3 2 3 7 8 31 69 64 9 3 3 3 2 1 2 2 1 1 1 2 1 2 23 20 1 1 2 2 1 1 2 2 1 3 7 100 6 2 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 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 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; 1HNMR: 77 77 ddt 2H J 9 18 161 \| 72 71 m 2H \| 71 71 s 2H \| 71 70 m 1H \| 55 55 dq 2H J 9 18	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nc(Cl)cc(NCCCN2CCCC2=O)n1	ir: 13 13 4 7 2 4 6 6 2 5 6 3 2 5 5 2 4 7 10 1 3 7 8 6 2 3 6 1 2 2 2 1 1 2 2 1 2 2 2 1 1 3 2 2 3 3 2 1 2 4 3 0 14 100 58 30 18 6 6 5 1 2 1 3 9 15 10 2 2 3 1 1 4 2 3 0 1 2 1 1 1 2 4 5 2 2 1 1 2 1 0 0 1 1 0 1 4 2 1 0 2 1 1 1 2 1 0 7 6 4 3 2 4 2 3 2 1 2 4 5 6 12 4 3 5 2 1 3 3 19 5 3 2 3 3 2 2 1 2 4 4 10 9 18 48 40 33 27 69 35 8 2 2 2 1 2 2 4 59 5 3 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 2 2 1 2 1 1 2 1 6 6 2 3 7 4 2 1 1 1 1 1 1 2 1 1 1 1 2 2 1 3 5 7 2 5 12 15 19 25 10 3 1 4 14 54 7 3 2 1 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 1 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; 1HNMR: 63 63 s 2H \| 59 59 s 1H \| 57 56 t 1H J 49 \| 36 35 td 2H J 50 67 \| 35 34 m 2H \| 34 34 t 2H J 59 \| 25 24 t 2H J 57 \| 20 19 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CS(=O)(=O)c1cccc(-c2ccc(CN(CC3CCC3)S(=O)(=O)c3ccccc3C(F)(F)F)s2)c1	ir: 1 4 4 5 1 8 5 4 2 5 9 13 6 4 7 4 16 4 19 3 0 3 3 1 2 7 5 2 3 4 10 11 12 7 6 3 5 3 4 7 15 11 18 17 10 5 6 9 6 6 4 0 3 5 6 3 2 14 4 1 2 7 3 6 24 14 27 12 11 4 2 1 3 5 10 7 14 8 2 5 17 12 23 20 19 12 83 25 22 18 11 3 4 2 2 2 5 5 100 18 30 4 4 4 5 15 30 32 10 5 1 2 4 2 1 2 4 3 2 6 13 6 1 2 6 6 2 3 3 2 1 3 3 1 2 5 11 4 1 3 24 10 4 4 3 2 1 3 3 7 4 3 3 1 2 4 2 0 1 5 3 1 1 3 2 0 1 3 2 0 1 3 1 0 1 3 1 0 2 3 1 0 2 3 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 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 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 3 5 1 1 3 2 1 2 5 4 1 2 6 7 9 5 15 21 57 35 14 4 3 3 3 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 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 1 2; 1HNMR: 81 80 t 1H J 22 \| 79 78 m 2H \| 78 77 m 2H \| 76 76 ddd 1H J 15 66 105 \| 76 75 m 2H \| 72 72 d 1H J 70 \| 70 70 dt 1H J 9 69 \| 45 44 d 2H J 7 \| 32 32 d 2H J 49 \| 32 31 s 2H \| 22 21 m 1H \| 18 17 m 4H \| 16 15 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1c(S(C)(=O)=O)ccc(C(=O)O)c1C	ir: 7 8 22 5 5 3 2 3 3 3 7 14 8 14 9 5 17 16 22 39 15 59 15 28 8 7 10 7 5 3 2 6 4 1 1 3 7 7 3 18 5 1 2 3 2 0 1 3 2 2 3 2 4 7 39 21 3 4 2 7 3 0 2 5 3 2 4 13 42 6 5 4 6 15 8 8 30 46 100 31 20 10 27 12 8 16 15 3 1 1 2 3 2 1 5 7 2 1 5 3 1 3 11 4 6 18 29 6 2 2 3 2 3 6 4 3 5 6 17 25 3 10 6 3 3 5 7 2 2 3 3 2 2 5 10 3 2 4 11 22 8 6 5 3 4 4 3 1 2 13 8 2 1 3 4 1 1 3 2 0 4 3 2 0 1 3 2 0 1 3 1 0 1 3 1 0 2 3 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 5 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 1 1 2 1 0 1 2 1 0 1 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 1 1 2 2 1 1 2 2 1 1 2 2 1 2 4 2 1 1 2 2 1 2 3 2 2 4 29 30 20 13 4 17 0 2 3 2 1 2 2 12 26 5 5 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 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 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 78 78 d 1H J 97 \| 77 77 d 1H J 95 \| 42 41 q 2H J 62 \| 33 32 s 3H \| 24 24 s 3H \| 15 14 t 3H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1=C2CC[C@H]3[C@@H]4CC[C@H](C(C)O)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1=O	ir: 10 7 6 6 5 5 5 2 6 4 7 9 7 2 3 3 2 2 4 6 4 28 22 2 3 5 1 1 6 22 2 5 2 2 1 2 2 4 4 5 17 6 3 1 5 2 2 2 2 6 7 10 4 1 2 3 3 2 2 2 5 3 4 6 5 7 11 8 8 6 6 3 12 5 12 24 11 26 24 12 8 13 13 19 18 33 53 46 100 40 65 30 20 4 9 8 3 3 2 9 6 8 12 12 13 9 13 12 12 12 14 12 24 21 31 21 45 12 16 15 19 8 25 13 25 26 6 4 6 7 12 6 2 4 6 6 8 18 19 14 43 20 13 3 1 2 3 0 1 2 2 1 1 2 2 10 20 3 1 1 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 1 0 1 1 1 1 1 1 1 2 2 2 3 3 7 5 5 6 16 14 28 16 6 5 6 13 11 93 32 19 11 4 2 1 6 2 2 3 12 5 0 1 2 1 1 1 1 0 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 38 37 qtd 1H J 34 47 60 \| 26 25 m 2H \| 25 23 m 2H \| 23 22 m 1H \| 20 19 m 2H \| 18 12 m 16H \| 12 10 m 7H \| 8 8 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNC(=O)C=Cc1ccc(OCc2ccc(C)cc2)cc1	ir: 0 1 3 1 0 2 3 1 2 2 5 6 8 6 7 3 2 1 2 1 14 34 3 2 1 1 1 1 1 1 5 10 4 3 2 1 6 16 2 3 2 2 1 4 2 1 1 1 4 6 3 13 13 61 57 72 13 1 4 2 1 0 1 1 1 1 5 3 10 16 2 2 1 1 1 2 1 2 1 1 5 14 7 25 0 2 2 3 2 2 3 2 1 2 4 16 2 6 2 5 34 2 2 1 1 3 15 1 2 1 1 0 1 1 1 1 1 1 2 1 2 1 4 21 5 12 6 2 4 5 3 1 0 0 1 0 1 1 1 1 1 4 20 13 31 100 25 76 97 24 14 11 15 19 1 2 1 0 1 2 6 0 1 1 1 0 1 13 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 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 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 0 0 0 0 1 0 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 1 2 3 3 9 10 54 97 94 27 12 3 8 4 2 2 1 3 1 1 1 1 1 1 1 1 1 1 1 4 14 20 26 4 10 6 2 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 76 75 dd 1H J 9 161 \| 75 75 m 2H \| 73 72 dt 2H J 9 79 \| 72 72 dt 2H J 8 72 \| 69 68 d 1H J 161 \| 68 67 m 2H \| 57 56 q 1H J 50 \| 51 50 t 2H J 9 \| 27 27 d 3H J 51 \| 23 23 d 3H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(COc1ccccc1)NC(=O)CCCCCl	ir: 0 0 0 0 1 0 1 1 2 2 2 1 0 1 2 1 0 0 0 1 1 2 2 0 1 0 1 2 5 31 15 10 5 5 6 15 14 5 4 8 15 9 9 9 11 3 2 2 1 1 1 1 1 1 2 1 1 1 0 0 1 1 1 2 5 1 2 4 8 4 3 1 1 1 1 0 0 2 2 5 1 0 0 0 1 0 0 0 0 1 0 1 1 1 0 1 1 2 2 1 1 1 0 0 1 1 1 2 1 1 2 5 5 3 2 2 1 2 3 4 2 2 1 1 1 0 1 1 1 3 4 2 1 1 1 3 1 1 1 2 3 1 15 51 30 100 78 26 5 3 1 1 7 1 1 1 0 0 0 11 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 1 3 1 2 2 6 1 2 1 1 1 1 2 4 21 16 5 9 25 4 7 2 3 1 1 1 1 1 1 0 1 0 1 1 0 1 1 1 4 4 20 45 26 10 4 2 2 1 1 1 1 0 0 1 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; 1HNMR: 73 72 m 2H \| 70 70 tt 1H J 14 75 \| 69 69 m 2H \| 64 63 s 1H \| 41 41 s 2H \| 36 35 t 2H J 33 \| 23 22 t 2H J 76 \| 19 18 m 2H \| 17 16 m 2H \| 14 14 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCC(Br)C(=O)N(C)C	ir: 4 4 2 3 4 3 2 2 3 5 3 6 3 2 0 3 3 4 2 4 6 2 2 10 3 3 9 4 4 3 3 2 2 2 2 9 18 6 3 3 2 1 2 3 2 1 3 3 2 1 4 3 2 1 1 2 2 1 2 3 4 3 2 4 2 0 3 3 2 3 5 3 1 2 3 3 1 1 2 2 1 1 2 2 1 4 2 2 2 2 3 6 9 7 4 4 4 1 6 7 2 2 2 2 1 2 3 3 2 2 3 3 2 5 6 13 13 10 7 7 5 10 12 5 6 19 7 12 2 7 8 2 2 6 9 8 12 4 5 1 2 3 3 2 2 5 41 100 2 3 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 2 2 1 0 2 2 1 1 2 2 1 1 2 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 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 1 1 1 2 1 2 3 2 2 1 3 5 3 2 6 6 4 7 4 5 15 2 4 3 2 1 2 3 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 45 44 tq 1H J 15 59 \| 30 29 s 5H \| 22 20 dqd 1H J 59 69 139 \| 19 18 dqd 1H J 59 70 139 \| 11 11 td 3H J 15 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CNc2cccc(F)n2)cc1	ir: 66 24 7 4 7 13 8 4 5 4 5 4 6 5 7 4 5 5 3 3 2 3 3 3 3 3 3 2 3 3 3 3 11 6 4 3 2 3 3 2 3 4 3 2 5 8 22 13 5 3 3 4 5 18 40 11 4 5 4 3 4 4 6 5 4 9 3 2 3 4 3 2 3 3 3 2 3 3 9 8 3 4 4 2 3 3 3 6 4 3 2 4 5 3 4 3 6 6 4 3 3 3 2 3 4 3 8 14 2 3 2 3 3 3 2 3 4 3 4 9 7 3 2 3 4 5 4 4 5 6 2 3 4 2 3 6 11 7 6 19 23 17 7 2 2 8 4 5 9 6 5 4 6 5 5 13 4 100 80 0 3 18 15 3 3 3 2 2 2 3 2 2 2 3 2 2 3 3 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 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 2 2 2 2 3 2 2 3 3 2 3 3 3 3 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 3 5 6 23 85 18 7 7 5 5 5 4 3 3 3 3 3 3 3 3 3 3 4 3 3 15 15 4 28 46 12 5 4 2 2 3 3 3 3 3 3 3 3 2 2 2 3 3 2 2 2 2 3 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 3 3 2 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 3 2 2 2 3 2 2 2 3; 1HNMR: 77 76 td 1H J 49 75 \| 74 73 dp 2H J 10 80 \| 70 69 ddd 1H J 12 75 103 \| 69 69 m 2H \| 64 63 dd 1H J 11 75 \| 63 63 t 1H J 53 \| 46 46 dt 2H J 9 54 \| 38 38 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1Nc2cc(C(F)(F)F)ccc2Nc2cc(Cl)ccc21	ir: 3 3 4 2 1 2 11 9 2 1 1 1 1 0 0 4 5 4 0 4 1 2 1 1 2 3 5 3 1 1 7 4 2 11 12 6 1 1 2 2 8 18 6 1 1 2 4 1 1 0 0 1 1 4 29 10 1 2 1 1 1 0 0 1 1 0 5 6 3 2 1 2 1 0 0 1 1 1 1 0 0 0 0 0 1 1 0 0 1 1 4 2 1 1 1 4 11 5 29 11 1 20 6 6 1 1 1 1 1 5 1 2 4 5 13 2 0 1 4 1 0 1 1 2 2 7 1 1 1 2 14 2 1 1 1 1 1 1 11 10 4 4 6 5 1 1 3 6 6 1 6 3 4 5 5 2 2 10 7 5 2 2 21 0 2 1 1 0 0 1 0 0 0 1 0 0 1 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 1 1 1 1 1 0 1 1 1 0 1 2 2 2 8 100 18 5 1 1 2 1 1 1 1 1 1 0 1 1 1 0 1 2 2 1 2 5 8 20 26 64 30 5 1 2 1 1 0 1 3 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 1 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 99 99 s 1H \| 94 94 s 1H \| 80 80 d 1H J 83 \| 79 79 dq 1H J 9 20 \| 76 75 m 1H \| 75 74 d 1H J 22 \| 73 73 d 1H J 74 \| 72 72 dd 1H J 22 82	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C#CCn1c(-c2cc(Cl)nc(Cl)c2)nc(OS(=O)(=O)C(F)(F)F)c(CC)c1=O	ir: 1 4 4 6 10 13 14 7 17 59 43 10 5 5 2 3 12 7 2 2 5 25 4 11 3 6 3 6 3 3 3 16 13 3 3 3 6 7 5 2 1 0 2 3 2 3 9 23 13 5 8 3 4 1 4 2 4 6 4 3 8 8 6 3 3 7 8 40 17 9 17 24 3 5 5 4 7 5 8 23 4 3 2 3 2 39 11 2 20 13 1 1 2 2 0 2 10 11 17 5 3 3 0 2 2 2 1 1 2 1 0 1 3 4 2 3 2 5 3 3 6 8 6 5 5 1 3 3 3 2 5 47 8 3 5 4 9 4 16 9 14 4 2 8 4 4 4 23 36 4 1 3 10 2 1 3 3 100 5 2 1 4 1 1 1 0 1 1 1 0 1 1 1 0 1 1 4 1 1 2 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 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 1 2 3 8 12 5 24 35 10 7 9 3 2 2 1 1 1 1 1 1 1 1 1 19 6 2 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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; 1HNMR: 82 81 s 2H \| 47 47 d 2H J 26 \| 27 26 t 1H J 25 \| 25 24 q 2H J 72 \| 12 12 t 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCCN(C)C1CCN(Cc2cc3c(N4CCOCC4)nc(Cl)nc3s2)CC1	ir: 2 2 3 3 3 4 5 7 3 3 3 2 1 6 5 3 6 3 6 4 2 3 3 2 2 3 4 7 2 3 8 1 2 4 2 2 4 4 11 37 48 7 3 4 4 3 2 2 2 3 3 2 3 4 4 3 5 6 4 2 2 3 2 2 3 4 3 7 4 4 3 0 13 21 4 2 4 8 2 2 12 10 8 6 2 16 5 10 15 9 8 9 4 3 9 5 5 6 11 10 7 6 5 2 3 2 7 5 3 1 2 2 6 7 9 3 7 13 5 3 4 5 2 2 4 4 1 4 3 3 3 6 4 3 2 3 6 11 4 6 48 7 49 26 4 4 3 3 3 24 100 2 2 3 2 1 3 4 19 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 4 3 3 2 2 1 2 2 5 7 5 1 2 3 12 6 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 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 0 1 1 1 0 1 1; 1HNMR: 70 70 t 1H J 9 \| 39 38 m 6H \| 37 36 m 4H \| 35 34 t 2H J 65 \| 33 33 s 2H \| 29 28 pq 1H J 15 57 \| 28 27 ddd 2H J 49 76 123 \| 27 26 t 2H J 65 \| 25 24 ddd 2H J 49 77 119 \| 23 23 d 3H J 14 \| 19 18 dddd 2H J 49 58 77 117 \| 17 16 dddd 2H J 49 58 77 115	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(N[C@@H](CO)c1ccc(F)cc1)c1ccc([C@H]2CNCCO2)cc1	ir: 10 5 7 5 6 6 11 8 10 11 9 12 13 15 20 16 11 11 12 22 35 6 8 5 5 5 5 6 7 7 20 40 20 10 5 3 6 7 13 10 61 42 18 13 6 6 20 29 25 7 10 5 6 20 34 69 30 0 6 26 6 2 4 6 7 4 5 4 6 13 25 9 9 5 6 5 5 7 4 7 7 4 4 4 4 5 4 9 7 11 11 22 28 32 30 20 22 16 8 5 6 7 10 4 3 4 7 6 7 8 3 5 6 17 19 62 23 8 5 6 6 5 10 9 4 11 14 16 5 4 6 4 3 3 3 3 4 5 3 4 7 9 48 35 51 30 13 12 20 11 7 3 16 5 5 4 5 4 2 3 2 3 3 4 3 3 2 2 3 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 3 3 2 2 2 2 2 2 3 3 2 2 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 3 2 3 3 2 3 3 2 2 3 3 2 2 2 2 3 2 2 3 3 2 3 3 3 3 3 3 2 2 2 3 2 2 2 2 2 2 3 3 2 3 3 3 2 2 3 3 3 3 3 3 3 3 4 3 2 4 4 3 3 4 5 9 4 40 61 18 6 11 14 33 11 8 7 5 4 6 4 3 4 4 4 6 8 80 100 12 7 10 12 26 29 3 3 3 3 2 3 3 3 2 2 3 3 2 2 3 3 2 3 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 79 78 m 2H \| 74 73 m 2H \| 73 72 m 2H \| 71 70 m 2H \| 69 69 d 1H J 86 \| 49 49 m 1H \| 47 46 m 1H \| 42 41 ddd 1H J 43 57 124 \| 39 38 m 2H \| 38 37 ddd 1H J 19 39 114 \| 33 33 ddd 1H J 11 50 132 \| 32 31 tt 1H J 39 49 \| 31 30 ddd 1H J 38 49 132 \| 31 29 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CSc1ccc(Oc2ccc(Cl)cc2)cc1	ir: 4 3 2 2 2 3 3 3 3 3 3 4 3 2 2 2 2 2 2 2 2 2 4 4 3 3 2 2 2 2 2 4 2 2 2 2 2 2 2 2 2 3 2 2 2 3 2 1 2 4 4 0 7 16 100 50 14 0 3 4 2 1 2 5 2 1 2 2 12 3 2 3 2 2 3 3 2 2 2 2 2 4 2 3 10 4 4 4 2 2 2 2 2 2 3 4 4 4 3 3 2 2 2 2 2 2 3 2 3 2 6 7 15 10 3 5 4 3 4 3 4 8 6 5 4 5 3 2 6 2 2 2 2 2 2 2 2 2 2 2 2 2 3 10 22 11 17 9 7 5 3 8 7 3 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 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 3 3 3 3 2 3 2 2 6 7 7 18 33 15 10 6 7 4 4 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 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: 75 74 m 2H \| 74 73 m 2H \| 71 71 m 2H \| 70 70 m 2H \| 42 41 q 2H J 66 \| 36 36 s 2H \| 13 12 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(Nc1ccc2c(cnn2CCN2CCCC2)c1)C1CCC(c2ccc(Cl)cc2)CC1	ir: 6 3 1 16 14 8 5 1 1 2 6 4 7 6 14 3 4 4 9 11 3 4 2 2 2 1 4 4 3 6 13 6 6 7 4 5 8 16 35 22 6 6 4 2 2 4 10 9 8 3 3 6 12 9 30 10 7 5 7 2 4 2 1 3 4 5 4 13 15 14 3 0 3 4 1 2 2 2 21 13 3 3 2 4 2 3 6 8 8 3 3 4 10 7 28 5 12 6 5 5 2 3 2 2 4 6 23 12 28 25 9 7 16 8 9 7 8 10 7 2 9 4 15 6 5 3 1 3 4 3 4 21 8 2 3 6 7 1 1 2 3 5 28 6 1 23 100 86 17 30 13 5 6 21 25 30 37 4 1 1 1 0 1 1 4 1 1 1 1 0 1 1 1 0 0 1 0 0 0 1 1 0 0 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 1 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 5 5 4 4 5 3 3 8 6 7 10 18 16 65 59 38 15 15 4 3 3 2 1 1 1 1 1 1 1 1 1 2 2 2 4 3 6 12 67 15 10 3 3 1 2 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 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 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: 95 94 s 1H \| 82 81 t 1H J 20 \| 80 79 d 1H J 18 \| 76 75 dd 1H J 20 88 \| 75 75 d 1H J 86 \| 73 72 m 2H \| 72 72 m 2H \| 43 43 t 2H J 38 \| 29 28 t 2H J 38 \| 27 26 m 6H \| 22 20 dddt 4H J 58 88 135 191 \| 19 18 m 1H \| 18 18 m 5H \| 18 16 ddt 2H J 60 88 135	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1nc(C(F)(F)F)c(Br)c(CO)c1Br	ir: 1 5 3 2 2 3 3 2 2 1 2 1 1 1 1 1 3 5 4 5 3 2 2 4 7 3 3 8 9 3 2 1 1 3 2 1 2 1 1 1 2 4 28 7 2 3 2 1 1 2 2 1 3 7 3 0 1 3 1 2 3 3 2 1 1 3 1 1 1 2 2 10 4 3 1 6 2 2 2 2 3 3 3 2 6 9 17 35 68 12 25 20 5 4 3 4 1 3 65 13 2 2 1 1 2 1 1 1 2 2 3 10 1 2 1 1 2 1 0 2 3 3 40 16 10 4 1 3 3 3 4 3 2 2 1 1 1 1 1 1 1 0 1 4 23 1 1 2 2 14 37 2 1 1 1 1 1 0 1 1 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 4 6 4 5 2 2 4 5 4 3 4 5 7 9 6 11 6 4 6 5 4 10 10 4 4 3 10 79 100 19 7 4 4 12 4 3 3 2 4 2 4 4 10 2 3 3 3 3 2 2 1 2 2 3 2 4 3 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 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; 1HNMR: 51 51 d 2H J 58 \| 50 49 t 1H J 58 \| 40 40 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NCc1c(Cl)cccc1Cl	ir: 1 1 0 0 0 0 1 0 0 0 0 1 1 1 0 0 0 1 0 0 0 1 2 2 0 1 1 0 0 0 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 29 9 16 2 0 0 1 1 1 1 1 1 1 2 15 11 8 4 3 2 1 3 2 12 100 38 14 3 3 3 3 2 1 1 1 4 5 5 1 1 1 0 1 2 2 2 3 1 1 1 1 1 1 1 0 1 1 0 1 1 0 1 1 1 0 0 1 1 1 0 1 1 2 2 5 4 2 1 1 2 2 3 7 4 11 14 9 12 1 2 2 13 11 10 4 2 1 1 1 1 1 1 1 1 1 0 1 1 1 3 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 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 1 0 0 0 1 1 0 1 1 1 0 0 1 0 0 1 2 4 8 6 3 2 1 1 1 1 1 1 1 2 2 6 8 17 7 8 6 4 2 5 78 18 7 0 0 1 2 3 2 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 d 1H J 49 \| 74 73 s 2H \| 40 40 t 2H J 68 \| 19 18 t 2H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC(=O)C1C=Cc2ccccc2N1C(=O)c1ccccc1	ir: 2 2 1 1 2 1 1 2 2 5 5 13 10 7 3 18 16 6 3 3 14 7 16 10 5 5 3 9 4 8 67 56 32 25 35 41 57 16 4 1 12 9 27 49 74 23 14 2 1 4 2 1 2 8 8 2 2 11 3 1 2 3 2 3 2 2 4 3 7 8 4 1 3 4 2 8 5 18 8 7 2 2 2 5 3 3 2 2 7 6 3 8 30 4 1 7 3 2 1 6 8 5 4 5 6 2 1 1 2 1 1 2 2 2 2 6 11 10 3 4 6 2 3 4 14 6 4 5 5 5 5 2 2 5 14 41 6 3 16 14 6 33 19 8 19 34 14 20 4 3 5 4 3 13 16 8 13 36 33 4 3 1 2 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 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 2 3 4 7 5 4 6 5 12 65 100 75 34 10 7 3 4 2 1 2 2 2 2 2 2 1 2 41 55 1 0 2 2 1 1 2 2 0 0 9 71 71 7 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 76 76 dq 2H J 17 84 \| 75 75 tt 1H J 16 74 \| 74 73 m 4H \| 73 72 m 2H \| 69 68 s 2H \| 66 65 dd 1H J 17 94 \| 61 60 dd 1H J 67 94 \| 53 52 dd 1H J 18 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCC1(OC)CCc2[nH]c3ncnc(Nc4cc5cn[nH]c5cc4OC(C)C)c3c2C1	ir: 2 2 1 1 2 7 5 2 3 2 1 3 13 8 2 3 6 5 4 4 2 2 2 3 3 4 6 5 9 4 6 3 2 2 1 2 2 3 2 1 11 7 3 11 16 7 2 2 2 1 2 2 2 1 1 2 1 3 2 1 1 0 4 2 2 1 6 9 4 1 2 1 1 1 2 2 1 3 3 4 2 2 1 2 2 4 12 2 1 1 1 1 1 1 1 1 2 4 4 20 3 2 2 4 11 5 3 2 4 2 2 5 13 2 2 2 2 4 3 2 3 3 2 2 10 3 1 2 2 2 2 1 1 2 7 6 2 1 1 1 1 1 1 4 1 1 2 13 3 2 3 2 2 1 1 5 19 6 4 100 7 4 2 0 1 2 2 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 2 5 2 2 7 5 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 2 2 4 18 30 16 28 11 6 3 3 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 98 98 s 1H \| 85 85 s 1H \| 84 83 s 1H \| 83 82 d 1H J 17 \| 79 79 d 1H J 17 \| 71 71 s 1H \| 47 47 p 1H J 57 \| 38 37 d 1H J 115 \| 35 34 d 1H J 117 \| 33 33 s 3H \| 33 32 s 3H \| 30 29 m 2H \| 29 28 m 2H \| 21 20 ddd 1H J 42 68 134 \| 19 18 ddd 1H J 42 70 134 \| 13 13 d 7H J 57	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(F)cc(CC(=O)O)c1)C(=O)OCc1ccccc1	ir: 10 5 3 4 4 6 4 9 19 18 8 18 9 16 5 6 8 9 5 9 27 47 34 45 10 10 11 3 9 8 8 7 12 3 2 2 2 4 9 34 67 3 4 7 4 4 5 5 5 6 3 3 3 4 12 10 2 1 2 3 2 1 1 2 1 9 12 17 29 19 15 7 2 2 2 6 14 9 24 35 14 7 4 3 3 5 3 6 10 33 6 13 13 9 5 3 1 9 31 28 11 15 3 5 2 2 2 1 2 1 3 2 10 39 13 5 3 7 9 15 19 10 4 9 4 19 11 18 11 5 7 3 7 5 6 5 2 2 2 2 2 6 14 14 15 8 12 4 8 11 42 33 3 5 6 1 1 2 5 12 1 3 1 1 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 1 1 2 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 2 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 2 1 1 1 1 1 0 1 1 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 2 2 3 1 2 3 5 4 3 2 2 2 6 9 11 36 40 100 55 15 6 6 2 0 3 7 17 27 7 2 1 1 2 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 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 78 77 dh 1H J 9 18 \| 77 76 ddt 1H J 14 35 112 \| 74 73 m 8H \| 72 71 dt 1H J 22 121 \| 71 70 dtd 1H J 10 21 121 \| 52 51 s 2H \| 45 45 d 2H J 10 \| 36 35 t 2H J 9 \| 34 33 q 2H J 74 \| 13 12 t 3H J 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc(Nc2ccccc2)c(C)c(C)c1OCc1ccccc1	ir: 8 4 6 4 7 16 25 13 9 11 13 2 4 4 4 9 12 24 9 27 11 12 6 4 7 3 5 10 15 29 22 10 9 6 8 3 15 39 30 78 64 36 18 11 6 7 14 3 3 4 1 2 1 0 2 1 1 0 1 1 1 2 2 4 3 9 8 17 29 29 6 4 1 3 2 3 2 3 3 7 6 0 1 2 1 0 1 1 13 9 3 1 6 3 1 2 2 8 8 8 7 28 8 15 58 16 19 8 2 2 2 1 2 2 4 3 5 10 9 17 3 9 10 5 5 4 6 3 2 7 2 4 4 13 23 53 12 4 2 4 10 14 9 27 18 68 29 9 5 1 1 12 18 51 73 7 4 1 1 2 13 70 19 5 2 3 2 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 2 2 2 1 1 1 1 2 3 2 2 2 7 4 14 27 22 100 32 21 8 9 3 2 2 1 2 1 1 1 2 2 3 3 2 2 4 4 6 7 8 24 80 40 86 8 12 3 2 1 1 1 1 0 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; 1HNMR: 81 80 s 1H \| 77 76 m 2H \| 74 74 dq 2H J 10 74 \| 74 73 m 2H \| 73 73 tdd 3H J 13 22 68 \| 69 68 tt 1H J 12 69 \| 51 51 t 2H J 9 \| 24 24 s 2H \| 22 21 d 6H J 48	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(F)c2c(c1)CC(=O)N2	ir: 2 4 4 5 1 5 11 15 11 30 8 4 2 3 4 3 2 8 10 7 10 11 13 23 13 16 11 5 5 5 7 3 3 3 11 3 9 6 3 1 2 3 4 2 2 4 3 5 11 11 5 1 2 4 2 0 3 6 3 0 3 5 2 1 8 15 16 26 35 27 22 4 4 5 2 1 3 3 2 1 3 3 1 2 3 4 1 1 3 3 1 9 13 5 6 3 3 3 1 2 6 9 6 2 3 3 3 6 5 3 1 2 4 2 1 13 5 9 0 3 4 3 4 6 12 19 8 23 11 4 1 3 3 2 1 3 3 2 2 3 3 1 1 3 3 1 3 31 24 3 3 3 3 9 57 43 9 98 100 3 5 4 3 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 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 2 1 2 3 2 1 2 3 2 1 2 3 1 1 3 3 1 2 3 3 2 2 3 2 1 2 3 2 1 2 4 4 3 4 4 3 1 2 3 4 14 5 15 8 6 24 7 8 2 3 3 2 1 3 4 2 2 3 3 2 2 3 3 2 2 3 5 30 17 28 6 2 3 4 4 2 3 3 3 2 2 4 3 2 2 4 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 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; 1HNMR: 94 93 d 1H J 44 \| 68 67 dd 1H J 22 121 \| 67 66 dt 1H J 9 20 \| 38 38 s 3H \| 35 34 d 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCc1nc2ccccc2nc1Cl	ir: 1 1 0 3 7 9 4 2 4 4 4 2 1 1 2 7 22 28 12 7 2 1 1 4 4 1 1 1 3 2 1 1 1 1 1 1 1 1 1 1 1 4 26 40 100 31 5 5 2 2 1 1 1 1 2 6 4 1 1 3 4 2 2 1 1 1 1 1 6 11 11 13 2 2 2 2 4 2 4 2 1 1 1 2 1 3 20 12 8 2 1 1 2 2 1 7 3 3 0 2 3 22 5 7 17 11 5 2 1 2 3 3 3 4 3 2 16 9 6 4 1 1 2 5 5 7 3 3 3 7 3 2 1 3 4 6 3 2 2 1 1 5 3 4 3 10 11 11 3 5 1 5 8 1 1 5 5 14 2 0 1 1 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 1 2 1 2 3 2 2 2 2 1 4 7 8 5 23 29 59 14 5 4 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 80 80 dd 1H J 14 83 \| 80 79 dd 1H J 14 84 \| 78 77 td 1H J 13 85 \| 76 75 td 1H J 13 84 \| 28 27 q 2H J 78 \| 15 14 t 3H J 78	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1ccc(C#C/C=C/c2ccc(CN3CCOCC3)cc2)cc1	ir: 2 2 3 3 2 3 7 6 4 19 17 9 10 11 14 11 3 6 0 19 34 42 38 99 4 11 14 2 3 10 5 2 4 3 2 1 1 2 2 2 3 11 14 6 4 5 2 3 2 4 3 3 13 19 18 28 34 89 19 10 1 1 3 4 5 2 4 3 3 21 16 3 25 18 30 26 18 19 28 100 56 27 1 2 3 12 22 9 14 13 0 2 6 4 4 5 8 17 12 10 12 4 2 3 3 3 2 1 2 1 1 1 2 5 12 19 29 5 3 3 9 12 3 10 10 6 6 5 7 2 3 8 2 6 6 3 2 1 1 3 3 28 36 16 28 14 23 14 9 13 7 4 18 2 1 2 1 1 3 2 1 0 3 2 1 2 2 2 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 1 2 2 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 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 3 2 1 1 3 2 6 26 46 69 25 47 20 10 5 7 5 1 4 5 19 4 1 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 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 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 79 m 2H \| 76 75 m 2H \| 74 74 m 2H \| 73 73 dt 2H J 9 84 \| 69 68 dd 1H J 9 135 \| 65 64 d 1H J 135 \| 37 37 m 4H \| 36 36 t 2H J 9 \| 25 25 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OCC(O)CCl)cc2oc3ccccc3c(=O)c12	ir: 2 2 2 4 7 2 1 1 1 2 4 1 1 0 0 1 1 1 1 1 1 2 1 2 4 10 3 6 2 0 1 2 2 1 2 2 2 1 1 2 5 3 74 5 3 2 2 7 6 1 1 1 1 1 2 4 2 1 1 2 5 0 1 3 1 1 9 18 25 5 18 5 5 18 3 2 2 2 2 1 1 1 7 2 2 4 9 17 14 73 6 2 3 7 5 1 1 1 1 1 6 4 3 2 0 1 1 3 15 6 3 4 2 1 1 2 2 4 2 1 1 4 2 2 0 4 4 2 1 1 1 1 2 8 4 1 6 17 1 1 1 1 1 1 1 5 2 0 6 1 1 0 1 2 1 2 2 42 4 4 16 3 39 5 2 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 1 1 1 0 0 1 1 0 1 0 0 0 1 1 1 1 1 2 2 2 1 1 1 2 2 3 7 6 19 96 33 11 3 1 2 3 4 100 3 0 1 1 1 0 1 1 0 0 0 1 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 1 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; 1HNMR: 82 82 dd 1H J 15 77 \| 77 76 td 1H J 15 77 \| 75 74 dd 1H J 12 80 \| 74 74 td 1H J 13 78 \| 66 65 d 1H J 22 \| 63 63 d 1H J 24 \| 43 42 dd 1H J 42 125 \| 42 41 m 1H \| 40 39 dd 1H J 42 125 \| 40 39 s 3H \| 39 38 dd 1H J 28 116 \| 36 35 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCC(C)OS(=O)(=O)c1ccc(C)cc1	ir: 5 4 4 4 4 6 7 7 11 9 10 12 17 7 6 6 4 3 3 2 2 3 3 2 11 5 2 2 2 2 2 3 3 3 2 2 2 3 4 3 7 7 4 4 3 4 6 4 3 3 3 2 17 22 4 3 3 3 2 2 2 5 3 3 4 23 21 7 3 6 5 3 4 2 3 4 5 3 3 3 2 16 6 6 100 13 3 6 25 5 3 3 0 67 32 1 4 4 1 2 4 3 1 2 3 3 2 3 3 3 3 2 4 4 4 3 3 4 3 4 5 4 3 5 7 9 4 3 4 3 3 3 3 2 2 3 3 2 2 2 2 2 2 3 3 4 5 9 4 4 2 3 3 2 2 3 2 2 2 3 5 3 2 2 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 3 3 2 2 3 3 2 2 3 3 3 7 10 21 15 7 7 6 4 4 4 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 2 2 2; 1HNMR: 77 77 m 2H \| 75 74 dq 2H J 8 82 \| 46 45 h 1H J 66 \| 24 24 d 3H J 9 \| 17 16 m 1H \| 15 14 m 2H \| 14 13 m 4H \| 10 9 t 3H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N[C@H](CCn1cc(-c2ccc3[nH]ncc3c2)nn1)Cc1ccccc1	ir: 1 2 2 1 1 1 2 2 1 2 6 12 7 4 2 1 1 1 1 1 2 1 2 2 1 2 2 2 3 2 20 8 6 3 1 2 1 19 12 14 8 11 7 11 3 7 5 2 3 2 1 2 4 4 13 9 32 23 9 5 5 3 3 3 8 4 6 26 7 5 8 11 15 2 2 1 4 12 23 41 23 8 4 7 5 25 2 2 1 2 12 4 1 3 2 2 2 3 1 2 1 1 6 19 5 1 1 2 2 2 2 25 9 7 4 2 2 4 7 3 1 1 4 3 3 4 4 6 6 11 5 8 21 6 7 11 5 3 2 1 3 4 5 18 15 3 3 7 1 1 1 6 3 10 5 3 5 0 1 3 1 0 0 1 1 3 2 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 0 1 0 0 1 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 1 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 0 0 1 1 1 1 1 1 1 2 1 1 1 1 2 1 1 2 1 2 2 4 4 5 26 18 14 18 8 10 3 3 2 1 1 1 2 4 6 13 15 17 4 2 8 6 8 100 24 4 8 19 7 18 3 3 0 0 1 1 0 0 1 1 0 0 1 1 0 1 2 1 0 0 1 1 0 0 1 1 0 1 2 0 0 1 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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: 84 83 d 1H J 17 \| 81 81 t 1H J 20 \| 80 79 dd 1H J 22 97 \| 79 79 t 1H J 9 \| 77 76 d 1H J 97 \| 73 73 m 2H \| 73 72 m 1H \| 72 71 ddt 2H J 9 15 64 \| 43 42 dtd 1H J 9 62 148 \| 42 41 dtd 1H J 9 62 148 \| 32 31 m 1H J 53 \| 30 29 ddt 1H J 9 55 145 \| 28 27 ddt 1H J 9 54 147 \| 21 20 m 3H \| 18 17 dtd 1H J 50 63 156	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CC(=O)OCC(CC)CC1CCC(CCC)CC1	ir: 3 3 4 5 3 2 3 4 2 5 3 3 2 3 2 2 1 1 1 1 0 1 1 0 0 2 1 1 1 1 2 1 1 1 2 4 10 27 11 2 2 2 2 3 3 2 2 1 1 1 1 0 1 1 1 1 1 1 1 1 2 2 1 0 2 3 3 2 1 2 2 5 14 5 2 1 1 1 1 1 1 1 1 1 3 7 24 11 5 4 5 4 2 1 1 1 3 1 1 1 2 3 1 4 3 3 6 11 8 9 8 5 6 11 4 3 4 3 2 5 6 2 0 4 2 1 0 3 2 2 4 16 4 2 1 1 2 1 1 1 2 3 1 5 13 27 100 13 9 3 3 2 1 1 2 2 1 1 2 3 9 10 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 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 0 1 1 1 1 2 3 1 2 2 3 6 4 5 3 3 22 5 4 11 17 21 18 9 5 2 3 1 2 3 11 6 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 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1; 1HNMR: 61 60 m 2H \| 59 58 dd 1H J 39 102 \| 42 41 dd 1H J 64 111 \| 40 39 dd 1H J 65 111 \| 17 14 m 9H \| 14 11 m 11H \| 9 8 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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