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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
c1ccc(CSc2ncnc3ccccc23)cc1	ir: 2 1 0 1 1 2 3 3 2 2 1 3 5 5 1 1 1 3 1 1 1 1 1 1 2 4 36 27 8 6 12 5 2 1 2 17 34 51 15 11 25 13 7 40 35 11 17 12 90 100 7 2 1 1 1 1 1 1 0 0 1 4 11 4 2 1 3 3 15 1 1 1 1 1 3 4 1 2 2 1 2 6 5 2 9 11 3 5 14 11 4 2 1 1 2 46 13 7 4 1 0 1 1 1 1 1 0 14 15 4 10 8 3 2 21 5 0 1 2 1 1 2 6 6 1 1 2 1 1 2 1 7 45 80 13 16 31 9 3 1 13 19 22 16 1 4 4 8 8 6 10 8 6 2 3 98 26 6 2 2 1 2 2 6 31 7 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 0 1 1 1 1 1 2 2 2 2 1 1 1 2 12 15 26 27 60 20 25 8 11 4 6 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0; 1HNMR: 89 89 s 1H \| 81 80 td 2H J 15 87 \| 78 77 ddd 1H J 13 68 80 \| 76 75 ddd 1H J 13 70 90 \| 74 74 dq 2H J 10 72 \| 74 73 m 2H \| 73 72 ddt 1H J 13 64 79 \| 42 41 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cc(O)c2cc(-c3ccccc3)cc(OC)c2n1	ir: 9 3 5 4 39 11 4 7 4 5 5 3 6 4 6 9 2 3 3 2 2 2 3 3 3 3 3 2 3 5 6 17 12 3 5 4 2 1 2 4 8 65 7 3 2 2 2 2 2 2 4 29 3 4 3 5 2 2 2 1 2 2 2 9 4 0 35 25 5 13 7 2 3 2 3 3 5 4 5 4 4 58 100 15 5 8 7 16 13 4 2 2 2 3 5 2 3 3 5 2 1 1 1 2 1 2 2 9 2 8 4 5 3 5 4 10 3 5 6 3 4 3 4 2 1 2 3 4 2 2 2 1 1 2 5 19 4 25 4 3 2 4 24 52 7 12 5 7 10 14 39 11 6 0 2 3 5 10 2 2 8 16 5 2 1 1 1 1 1 1 1 2 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 2 2 2 2 2 2 2 1 3 2 2 2 2 1 4 3 2 3 5 11 10 37 66 45 22 7 6 6 2 8 61 46 8 4 3 2 2 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 2 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 83 83 d 1H J 22 \| 76 76 m 2H \| 75 74 m 2H \| 74 73 m 1H \| 73 73 d 1H J 22 \| 71 71 s 1H \| 40 40 d 6H J 13	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1nccc2c1nc(Sc1cc3c(cc1Br)OCO3)n2CCCO	ir: 1 3 4 6 9 9 3 7 5 3 3 4 5 2 2 3 2 2 5 4 5 2 5 2 1 1 2 2 2 3 9 10 7 3 4 4 2 3 4 2 3 3 2 3 9 19 2 3 3 3 2 2 2 1 2 1 1 1 1 2 2 1 2 1 10 19 15 14 24 5 4 4 1 2 1 2 1 3 1 1 2 4 5 2 3 7 5 6 24 15 10 10 1 2 2 3 6 2 1 2 1 1 2 2 0 6 15 9 10 29 5 5 3 2 1 5 2 4 4 8 8 8 6 2 2 1 3 2 2 2 1 1 0 1 2 9 4 1 1 4 2 2 3 14 34 10 5 2 1 2 2 14 2 3 9 26 9 3 1 1 1 1 18 11 1 0 0 1 3 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 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 1 1 2 2 4 10 3 3 3 3 1 2 2 5 11 18 32 49 74 38 10 10 4 3 6 21 27 6 2 5 5 4 3 23 16 4 3 4 0 4 15 100 14 5 3 2 3 0 1 2 1 1 1 2 2 3 1 1 5 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; 1HNMR: 82 81 d 1H J 48 \| 72 72 s 1H \| 71 70 s 1H \| 70 70 d 1H J 49 \| 65 65 s 2H \| 59 59 s 2H \| 43 42 t 2H J 65 \| 36 35 m 3H \| 20 19 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC#CCOc1ccc(S(=O)(=O)N2[C@H](C)CSC(C)(C)[C@@H]2C(=O)O)cc1	ir: 3 5 11 4 6 5 8 3 6 13 4 25 20 23 17 24 52 21 15 33 17 38 70 41 22 6 6 12 10 2 2 8 8 19 12 5 3 0 2 7 6 2 6 6 3 0 3 5 5 4 10 7 8 22 46 37 6 9 3 6 9 3 7 11 13 9 6 8 6 9 4 8 5 5 10 14 39 38 55 25 12 11 21 47 44 20 8 7 36 13 9 8 4 10 16 36 13 12 22 8 4 2 3 2 3 3 3 2 1 2 3 2 1 2 3 3 1 6 6 8 5 8 7 10 14 10 17 9 5 6 6 6 7 3 5 2 2 3 3 2 2 5 6 50 12 6 3 33 7 7 6 2 3 3 2 1 1 2 2 2 3 4 2 0 1 2 1 0 1 2 1 0 1 2 2 1 2 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 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 2 2 2 1 3 4 2 1 3 3 2 2 3 8 4 3 6 7 35 11 26 50 38 9 7 3 2 2 2 3 16 100 21 6 2 0 2 3 1 0 2 2 1 0 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 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: 82 82 s 1H \| 77 76 m 2H \| 71 70 m 2H \| 48 47 q 2H J 25 \| 41 41 d 1H J 26 \| 39 39 ddddd 1H J 15 41 68 81 108 \| 29 29 dd 1H J 40 114 \| 27 26 dd 1H J 68 114 \| 19 18 t 3H J 25 \| 14 14 s 3H \| 14 14 s 3H \| 14 13 d 3H J 81	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C1(c2ccc(C)cc2)CCNCC1	ir: 4 3 2 4 2 2 4 3 1 1 2 4 6 1 1 8 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 16 9 2 2 3 4 4 2 1 1 1 2 1 3 5 13 26 67 16 9 5 6 5 4 7 16 37 20 3 4 4 7 2 3 9 7 2 3 3 2 2 4 4 9 3 2 1 1 1 1 1 1 1 2 2 1 2 2 4 2 2 6 3 2 2 7 3 1 2 2 3 3 7 10 19 4 27 21 18 16 13 2 5 8 4 2 2 2 5 8 9 8 6 17 11 11 3 3 4 3 2 1 1 1 2 2 1 1 2 4 21 5 4 8 23 9 2 1 4 5 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 1 2 2 2 3 3 4 2 4 2 2 3 11 11 5 24 44 7 4 3 3 2 1 2 2 1 1 2 3 1 0 3 3 1 0 60 100 5 4 0 0 2 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 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; 1HNMR: 72 72 m 2H \| 71 71 m 2H \| 48 48 p 1H J 37 \| 43 42 q 2H J 60 \| 31 30 ddt 2H J 35 59 139 \| 29 28 ddt 2H J 34 59 139 \| 25 25 ddd 2H J 32 59 143 \| 23 23 d 3H J 10 \| 23 22 ddd 2H J 32 59 143 \| 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.
COCCNC(=O)CC(=O)C(=O)N(C)C	ir: 11 31 6 5 6 2 3 18 12 10 3 7 3 8 20 13 17 9 6 6 16 26 18 23 9 4 14 7 6 9 21 10 12 14 22 7 29 3 7 6 14 5 7 10 3 2 3 2 3 2 4 3 2 1 3 5 12 11 4 2 1 1 2 4 3 7 34 10 5 4 8 3 4 12 17 17 7 1 4 5 2 1 1 1 1 0 1 2 1 3 1 6 5 6 8 5 7 5 8 3 1 2 1 1 1 1 2 1 5 4 2 3 4 6 19 5 5 7 2 10 8 18 19 14 8 10 13 7 8 11 8 6 8 2 4 7 9 63 17 10 3 11 17 24 49 100 58 18 18 15 20 3 3 2 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 1 0 1 1 1 2 1 3 4 6 6 5 4 2 3 3 3 3 6 8 11 4 3 2 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 3 4 2 8 23 63 24 33 15 5 6 2 1 1 1 1 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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; 1HNMR: 77 76 t 1H J 51 \| 35 34 m 4H \| 34 33 m 5H \| 30 30 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1c2c(c(C(C)C)c(O)c1C(C)C)CCC(C)(CO)O2	ir: 5 2 2 1 2 2 3 2 2 2 2 2 3 2 2 1 1 1 1 1 1 1 2 1 2 2 1 2 4 3 2 1 2 2 1 2 3 2 3 1 1 1 1 2 1 1 1 1 1 1 2 1 2 1 1 2 2 1 1 2 2 2 2 1 1 2 1 2 2 1 2 2 2 2 2 2 2 1 2 2 2 3 9 11 26 18 7 16 7 5 6 3 4 3 3 2 2 1 1 1 2 2 1 2 2 2 2 4 2 1 1 1 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 3 3 3 3 2 2 1 2 1 1 1 1 2 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 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 2 1 1 1 1 2 1 2 1 2 1 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 4 8 3 3 2 2 3 1 1 2 5 2 100 18 0 2 3 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 56 55 s 1H \| 40 39 m 2H \| 37 37 dd 1H J 67 113 \| 33 32 heptd 2H J 33 66 \| 29 28 ddd 1H J 53 80 156 \| 27 26 ddd 1H J 53 81 157 \| 23 22 s 2H \| 21 20 ddd 1H J 53 81 135 \| 19 18 ddd 1H J 53 80 135 \| 14 14 s 2H \| 14 13 ddd 12H J 8 66 203	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H](Cn1ccc2c1-c1cc(F)ccc1C2)N=[N+]=[N-]	ir: 5 5 11 2 2 5 2 4 5 24 2 6 7 7 5 5 4 3 3 4 2 2 5 3 2 2 2 2 2 1 2 2 2 1 2 3 2 1 1 1 2 2 2 2 2 3 3 13 39 80 16 29 13 25 26 5 3 2 5 3 3 2 5 4 5 14 25 43 6 24 7 6 4 1 3 4 4 3 2 3 2 8 19 5 4 2 4 3 12 7 41 42 6 6 11 6 9 19 18 7 4 3 4 21 15 7 6 3 2 2 2 2 1 1 2 2 1 3 9 6 5 4 3 4 5 22 5 4 1 2 6 4 2 2 4 6 5 2 2 4 4 5 5 50 27 7 5 4 8 4 5 8 30 12 9 3 2 5 2 0 1 7 22 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 2 1 1 2 1 1 1 1 1 2 2 1 1 2 3 1 1 9 19 6 4 0 1 3 2 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 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 2 2 3 2 1 4 5 5 6 5 3 9 10 20 16 35 16 77 31 100 17 30 26 39 7 6 6 4 3 2 3 2 1 2 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 74 73 m 2H \| 71 70 ddd 1H J 22 76 95 \| 70 70 m 1H \| 61 61 dt 1H J 9 51 \| 46 45 t 2H J 9 \| 42 41 ddd 1H J 8 59 110 \| 39 39 ddd 1H J 9 60 112 \| 38 37 qt 1H J 60 77 \| 11 11 d 3H J 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1ncc(-c2nc(C(F)F)c(Cl)s2)c1C(=O)Nc1ccn2cc(-c3ccccc3)nc2c1	ir: 2 7 7 7 22 8 20 9 12 4 8 9 3 9 4 10 19 28 11 3 7 5 4 7 8 15 7 5 19 8 15 32 7 16 10 22 17 5 42 38 36 21 20 13 6 6 4 0 5 5 8 4 8 16 13 18 27 20 32 13 23 21 7 5 12 5 7 15 18 13 44 24 100 35 22 29 26 8 15 11 14 19 15 10 8 7 6 5 7 8 14 28 17 9 7 18 4 5 6 14 18 10 7 12 9 21 21 25 50 26 16 17 9 6 8 8 11 22 8 14 20 6 11 6 5 6 10 8 4 6 10 6 10 17 19 36 33 26 13 27 18 9 12 24 12 18 13 7 9 21 10 11 13 10 4 2 2 3 4 3 4 2 4 7 4 2 3 4 9 25 11 9 5 22 15 5 3 0 2 3 2 1 1 2 2 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 2 0 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 2 1 0 1 2 1 0 1 1 1 1 1 2 1 1 1 1 2 0 1 1 1 1 2 2 2 2 6 3 2 3 2 3 4 4 6 4 8 5 8 8 4 8 22 30 75 42 29 73 61 72 75 47 38 26 12 18 23 9 8 10 4 4 2 6 3 2 4 4 7 5 9 15 33 40 20 15 10 5 4 3 4 2 2 1 2 1 2 4 4 1 1 2 1 1 1 3 1 3 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 0 1 0 0 0 1 1 0 0 0 0 0 1 1 0 0 0 1 0 0 1 0 0 0 1 1 0 1 0 1 0 0 1 0 0 0 0 0 0 0 1; 1HNMR: 98 98 s 1H \| 92 91 d 1H J 75 \| 82 82 s 1H \| 81 80 m 3H \| 77 77 d 1H J 14 \| 75 73 m 3H \| 73 73 m 1H \| 72 72 s 0H \| 41 41 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2cc(Nc3cc(C)[nH]n3)nc(Oc3ccccc3)c2c1	ir: 1 4 2 2 3 5 2 3 0 1 4 2 4 3 5 3 6 7 4 5 3 4 3 7 5 3 10 23 23 20 12 14 18 14 16 3 2 5 5 3 10 28 6 4 3 6 5 12 64 23 6 10 4 3 8 5 2 1 2 3 4 1 1 3 4 11 23 16 37 8 11 6 3 3 15 6 8 5 2 7 6 1 1 1 1 0 1 1 0 1 1 1 1 1 2 12 10 4 8 9 33 18 5 4 15 8 3 2 3 3 1 1 0 3 2 2 1 3 4 2 0 3 7 1 0 6 4 4 1 1 9 3 0 3 9 6 25 7 7 2 1 8 15 5 70 21 0 4 11 4 7 21 8 13 8 5 7 2 30 10 100 24 6 2 1 1 1 1 53 2 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 1 1 1 0 1 2 1 1 3 3 14 16 22 47 30 30 24 6 5 3 1 1 2 1 1 1 1 1 1 1 2 2 2 3 2 9 9 30 75 27 19 11 8 3 4 1 1 1 1 1 1 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 93 93 s 1H \| 85 85 s 1H \| 79 79 d 1H J 22 \| 76 76 d 1H J 27 \| 76 75 dd 1H J 22 86 \| 74 74 m 2H \| 71 71 dq 2H J 16 82 \| 70 70 m 2H \| 58 58 s 1H \| 38 38 s 3H \| 23 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1COc2c(cccc2NC(=O)NCc2ccc(C(F)(F)F)cc2N2CCCC2)N1	ir: 5 2 2 4 3 4 4 3 5 2 5 4 3 7 5 21 8 10 4 7 6 6 12 13 12 5 10 10 9 24 91 25 11 6 4 5 13 28 7 19 38 56 21 22 15 13 11 17 91 56 25 9 23 12 22 30 4 2 6 2 7 5 8 4 2 4 20 5 21 3 4 3 4 9 3 5 2 3 6 3 2 3 3 2 2 2 4 10 6 4 9 11 10 8 9 6 4 5 6 14 4 4 10 15 10 11 14 15 7 3 3 7 20 31 15 6 8 7 9 5 3 10 7 5 17 7 4 4 3 4 11 29 9 4 2 7 5 3 3 2 2 2 12 5 10 13 7 26 65 12 51 0 81 18 8 5 4 1 3 8 100 16 2 2 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 2 3 2 4 3 3 3 2 3 3 3 5 10 2 11 51 53 18 4 4 1 2 2 3 2 1 2 2 2 1 2 3 2 3 3 4 7 10 26 94 80 24 8 5 4 9 2 2 2 2 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 95 94 s 1H \| 78 78 s 1H \| 78 77 dd 1H J 11 79 \| 77 76 dd 1H J 12 80 \| 73 73 m 1H \| 72 72 dt 1H J 9 77 \| 71 71 t 1H J 80 \| 70 70 dq 1H J 9 18 \| 69 68 t 1H J 57 \| 47 46 s 2H \| 46 46 dd 2H J 9 57 \| 36 35 td 4H J 18 35 \| 21 20 p 4H J 20	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOP(=O)(CCCCc1ccccc1)N(C)CC(=O)N1CCC[C@H]1C(=O)O	ir: 3 10 4 2 3 2 2 4 5 4 5 6 8 17 10 10 8 9 10 13 17 32 18 23 16 8 5 6 3 3 19 7 3 2 3 3 4 7 6 20 38 9 8 4 2 8 7 4 4 4 5 2 1 1 2 2 3 12 5 2 1 1 2 2 3 3 10 3 11 16 4 0 6 14 17 8 3 8 21 29 23 10 19 20 64 8 5 6 3 8 3 6 2 8 7 7 6 36 15 9 6 5 9 8 4 5 10 10 5 10 3 2 2 3 7 4 4 9 5 12 6 4 5 2 2 3 4 4 8 4 4 1 0 3 4 16 6 4 2 2 6 8 5 91 6 2 4 31 6 2 2 6 3 1 1 0 0 1 0 1 0 1 0 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 0 0 0 0 0 0 0 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 0 0 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 1 1 1 1 0 0 0 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 1 1 0 0 1 1 0 1 1 1 1 0 1 1 1 1 2 3 3 5 3 2 3 2 3 3 9 5 14 18 17 16 38 12 11 3 0 1 3 3 5 100 98 5 3 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 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 3H \| 72 71 ddt 2H J 9 17 77 \| 43 43 ddq 1H J 19 42 60 \| 41 40 dq 2H J 72 85 \| 38 37 d 2H J 70 \| 36 35 m 1H \| 35 34 m 1H \| 28 27 d 2H J 93 \| 26 25 tt 2H J 9 75 \| 22 21 m 1H \| 21 20 dtdd 1H J 34 51 72 122 \| 20 18 m 4H \| 17 16 m 4H \| 13 12 td 3H J 7 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(N(CC#N)c2ccccc2)c(C(=O)O)c1	ir: 2 1 1 2 4 3 2 3 3 2 2 6 8 11 5 7 13 5 6 19 12 10 66 20 8 6 3 0 4 5 5 3 0 2 2 1 1 2 2 1 13 100 10 2 4 2 1 1 3 1 1 0 2 2 7 3 3 10 3 2 2 1 2 1 3 7 7 5 16 7 4 4 2 7 3 25 33 8 6 56 13 25 6 2 2 2 2 2 1 1 3 1 1 1 2 1 1 2 1 2 1 2 3 5 2 1 1 3 3 2 1 3 10 3 2 3 5 7 7 3 2 3 2 2 1 1 2 2 1 1 0 1 1 1 1 5 2 2 2 1 1 3 4 23 3 35 7 16 18 7 23 3 3 14 7 8 2 1 1 1 1 11 3 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 22 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 0 1 0 1 1 1 1 1 2 1 2 1 1 1 2 2 6 8 7 20 97 39 7 8 0 2 3 1 1 9 31 2 0 1 1 1 0 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 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 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 1 0 0 0 1 0 0 0 0; 1HNMR: 73 72 m 4H \| 71 70 m 4H \| 45 45 s 2H \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(OC)cc(N2Cc3cnc4[nH]c(C(=O)N(C)C)cc4c3N(C)C2=O)c1	ir: 3 4 15 9 19 5 4 5 7 3 1 2 4 4 2 5 5 3 2 2 3 3 2 3 3 2 2 3 4 3 7 18 25 30 8 17 8 3 34 35 25 9 10 14 9 2 5 1 2 6 3 4 10 3 4 1 2 6 4 5 4 2 2 8 5 13 21 21 13 30 7 9 7 6 2 3 3 2 3 1 12 11 3 2 2 2 4 3 1 4 3 18 13 3 2 2 2 2 7 2 3 2 3 2 4 11 2 2 2 1 8 2 1 1 2 3 3 3 3 6 12 9 8 3 7 19 10 19 9 5 10 7 5 6 9 11 4 12 1 1 2 1 1 2 3 4 3 10 3 3 4 32 38 4 3 6 78 15 9 28 50 29 10 10 9 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 2 7 13 3 12 100 12 4 9 12 3 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 4 2 13 65 6 1 1 3 2 1 1 3 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 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 97 96 s 1H \| 84 84 d 1H J 9 \| 75 74 s 1H \| 67 67 d 2H J 21 \| 63 62 t 1H J 21 \| 52 51 d 2H J 9 \| 38 38 s 6H \| 36 35 s 3H \| 32 31 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=C(CCCCCCNC(=O)OCc1ccccc1)C(O)C(NC=O)C(=O)OCC	ir: 10 11 5 4 5 4 5 2 3 4 6 2 2 1 0 2 2 1 1 2 3 3 4 3 4 1 15 26 22 27 15 13 13 13 8 7 5 3 6 26 14 6 3 3 4 6 3 2 1 2 2 2 1 1 1 1 1 1 2 3 4 4 2 6 3 4 4 2 4 5 7 7 8 9 9 8 3 4 10 7 3 3 2 3 5 3 5 11 22 18 7 5 4 3 2 3 2 11 5 2 1 2 2 2 2 4 14 9 9 3 4 2 2 10 6 5 2 3 4 9 20 29 22 9 3 8 3 4 7 9 6 2 1 2 3 13 2 2 3 2 4 3 21 32 71 100 35 7 4 77 6 2 1 2 2 5 7 2 3 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 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 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 3 4 8 5 2 2 3 4 7 5 7 8 5 12 17 20 11 4 4 15 5 16 32 11 3 2 2 1 2 2 2 2 1 4 8 3 9 15 35 40 12 15 5 5 2 2 2 1 1 2 1 1 1 1 1 1 1 2 1 1 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 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 82 82 dd 1H J 17 76 \| 75 74 dd 1H J 76 102 \| 74 73 d 4H J 41 \| 73 73 ddd 1H J 37 50 83 \| 52 52 tt 1H J 9 21 \| 51 51 s 2H \| 50 50 tt 1H J 9 20 \| 48 47 t 1H J 55 \| 44 43 ddt 1H J 22 48 72 \| 43 43 ddd 1H J 17 75 103 \| 42 41 m 2H \| 42 41 m 1H \| 34 33 q 2H J 55 \| 22 21 dtt 1H J 10 82 132 \| 21 21 dtt 1H J 11 83 132 \| 16 15 m 2H \| 15 12 m 10H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOCCNC(=O)c1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)s1	ir: 2 5 3 2 2 4 4 2 2 3 4 2 4 3 3 1 1 3 2 1 1 2 3 3 4 8 13 11 7 4 7 3 1 3 3 2 3 6 6 2 5 9 15 17 15 21 7 6 19 14 3 0 6 8 6 100 6 4 4 4 5 3 3 3 4 2 2 1 7 17 3 9 4 4 6 3 3 12 7 4 2 2 1 1 1 2 3 2 2 2 25 1 1 2 3 3 4 3 5 3 2 13 2 1 2 3 7 2 2 1 1 3 17 12 12 4 2 10 2 5 20 7 8 9 9 12 11 3 7 5 2 2 1 1 2 1 1 1 2 1 2 2 3 20 33 18 30 52 48 9 33 7 16 3 2 4 3 0 1 2 2 3 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 2 3 2 0 4 12 6 3 42 71 9 14 16 3 5 5 2 0 2 3 1 1 2 3 2 2 2 2 3 3 2 21 12 8 5 21 4 2 4 2 0 1 2 2 1 1 2 2 1 1 2 2 0 1 2 1 0 1 2 1 1 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 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 86 86 t 1H J 50 \| 76 76 m 4H \| 75 74 m 4H \| 36 36 m 2H \| 36 35 dd 2H J 34 39 \| 35 35 q 2H J 62 \| 11 10 t 3H J 61	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOc1ncccc1C(=O)NC1(C(=O)O)Cc2ccccc2C1	ir: 2 6 3 2 1 1 2 4 2 3 3 5 8 8 5 3 2 5 6 6 4 25 39 12 11 3 4 4 4 3 3 3 3 1 1 2 2 2 5 20 20 10 9 11 14 49 60 100 16 13 3 5 4 0 5 2 1 2 1 1 1 1 2 4 2 1 1 1 2 2 2 1 5 2 3 10 6 16 90 19 3 2 3 3 3 10 3 12 8 2 3 2 3 3 2 3 3 4 1 5 1 1 1 1 1 1 1 1 1 1 1 3 3 15 7 3 2 4 4 2 1 2 1 1 1 1 2 4 8 5 3 12 38 4 2 2 2 16 6 11 3 12 34 8 8 11 15 16 3 11 1 8 5 5 9 36 6 3 7 4 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 2 4 6 8 6 47 31 5 2 3 1 0 1 2 4 27 10 1 1 1 2 2 2 1 1 1 1 1 1 4 8 25 4 2 1 1 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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; 1HNMR: 83 83 dd 1H J 21 43 \| 82 81 dd 1H J 20 81 \| 81 81 s 1H \| 73 72 m 5H \| 47 46 q 2H J 68 \| 35 34 dd 2H J 7 150 \| 33 32 dd 2H J 9 150 \| 16 15 t 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)C1CCN(C(=O)C(Cc2ccccc2)NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ir: 5 5 11 6 5 3 5 4 10 20 3 2 2 2 5 7 5 5 7 2 8 4 4 4 2 2 8 8 8 21 31 9 7 30 33 4 9 1 3 5 35 4 45 6 4 4 7 2 4 5 3 2 13 12 7 4 3 3 3 1 4 4 3 3 4 10 9 12 6 7 2 2 2 2 2 4 3 3 8 5 3 2 2 2 2 4 3 6 23 25 4 2 2 3 4 9 3 4 3 10 7 2 13 11 3 5 3 2 4 4 3 6 9 8 6 3 5 3 3 12 3 4 6 6 15 12 8 4 5 7 5 3 3 5 9 20 4 16 3 7 28 55 18 20 8 23 62 16 3 15 16 6 69 2 3 1 2 3 2 0 6 4 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 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 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 2 2 1 3 3 4 3 2 3 2 4 3 7 14 13 8 55 48 12 4 4 3 2 2 2 3 5 3 5 2 1 2 4 2 3 3 11 3 3 6 9 70 25 100 21 6 7 3 2 2 2 1 2 1 2 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; 1HNMR: 97 97 s 1H \| 83 82 d 1H J 91 \| 76 76 t 1H J 22 \| 74 74 d 1H J 73 \| 73 72 m 2H \| 73 72 m 1H \| 72 71 m 4H \| 47 46 dt 1H J 70 90 \| 37 36 ddd 2H J 54 81 121 \| 34 33 ddd 2H J 54 81 119 \| 31 29 m 2H \| 29 28 ddt 1H J 9 71 141 \| 23 22 d 6H J 15 \| 20 19 dddd 2H J 53 62 81 116 \| 16 15 dddd 2H J 53 61 81 117	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOCC1COc2c(cc3ncc(C(=O)OCC)c(O)c3c2NC(C)=O)O1	ir: 2 2 2 2 4 4 5 2 3 3 10 2 2 5 5 3 4 6 8 8 2 2 5 9 7 7 16 11 6 11 5 6 31 28 10 37 47 52 84 41 10 14 10 5 2 2 2 2 2 2 9 19 24 8 3 5 4 3 2 2 4 2 4 1 4 4 7 23 36 21 9 6 10 7 5 7 4 4 1 1 2 3 7 1 4 4 16 23 2 4 11 7 3 5 16 9 4 5 7 2 2 2 1 2 9 8 6 8 17 18 7 5 9 14 13 11 6 5 2 5 9 9 5 11 12 6 2 4 4 3 1 1 3 0 0 2 2 0 1 21 20 2 1 10 23 30 35 9 9 2 1 2 10 5 2 1 3 2 2 2 5 40 26 1 5 100 2 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 2 3 2 2 2 2 3 3 2 2 1 2 3 7 9 20 13 6 21 24 10 10 50 22 23 4 2 2 2 1 1 1 1 2 3 2 3 2 3 4 17 16 18 16 13 7 4 2 2 1 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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: 93 92 s 1H \| 89 89 s 1H \| 72 72 s 1H \| 45 44 m 2H \| 43 42 q 2H J 64 \| 42 41 dd 1H J 46 113 \| 40 39 dd 1H J 45 118 \| 37 37 dd 1H J 44 117 \| 35 33 m 2H \| 22 22 s 3H \| 14 14 t 3H J 64 \| 4 4 t 3H J 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCOC(=O)c1cnc(N2CCNCC2)c(Cl)c1	ir: 9 11 10 22 7 12 13 10 7 13 12 3 7 6 9 5 5 7 20 7 13 10 6 1 0 5 5 2 6 9 13 7 4 17 12 36 58 77 39 61 6 8 7 6 8 11 8 4 4 8 12 14 17 62 100 29 14 36 19 22 37 25 13 10 40 28 11 44 33 8 7 19 8 8 3 1 4 5 2 1 5 8 10 22 24 17 29 27 22 32 10 6 8 7 13 8 17 7 8 6 11 6 7 15 9 11 7 23 67 36 76 34 31 20 19 44 23 47 28 22 15 12 14 26 64 27 35 35 11 26 34 11 8 6 3 4 4 6 17 49 26 7 4 4 89 15 75 26 7 1 3 7 6 4 18 16 27 5 3 9 25 78 32 16 4 1 3 5 3 0 3 5 3 0 3 6 3 1 3 5 2 1 3 5 2 1 3 4 2 1 4 4 2 1 4 4 1 1 4 4 1 1 4 4 1 2 4 4 1 2 4 3 1 2 4 3 1 2 5 3 1 2 5 3 0 3 5 3 0 3 5 3 0 3 5 2 1 3 4 2 1 3 4 2 1 3 4 2 1 4 4 2 1 4 4 2 1 4 4 2 2 4 4 1 2 5 4 2 3 5 5 3 5 8 11 3 6 11 4 1 4 6 7 10 16 14 30 26 10 18 9 4 4 6 3 1 3 4 3 3 6 7 8 10 9 33 46 9 77 6 4 3 4 4 1 1 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 0 3 5 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 2 3 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 3 4; 1HNMR: 87 87 d 1H J 16 \| 80 79 d 1H J 18 \| 43 42 t 2H J 55 \| 36 36 m 4H \| 29 29 m 4H \| 20 19 p 1H J 33 \| 19 18 qt 2H J 55 80 \| 10 10 t 3H J 80	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1onc(-c2ccccc2)c1C(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1	ir: 1 1 2 1 2 3 3 2 1 2 2 3 2 2 2 4 3 4 5 3 3 3 2 3 3 1 2 2 2 5 9 8 4 5 5 3 2 1 2 9 100 9 3 0 1 3 2 1 1 3 2 1 2 6 7 63 16 8 8 5 4 4 2 2 2 4 2 2 11 10 6 2 3 2 2 2 3 2 3 2 2 2 2 2 2 4 10 6 4 2 1 1 4 2 1 2 2 4 3 3 3 6 4 4 11 13 10 6 11 10 11 9 6 5 26 22 10 9 10 5 4 3 4 9 12 10 8 4 5 3 1 3 3 2 22 26 15 5 3 4 6 6 8 7 8 7 9 4 3 9 7 7 9 4 2 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 2 2 4 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 2 2 3 3 3 4 9 10 4 6 4 3 8 7 12 7 9 47 26 33 36 51 28 14 4 4 4 2 2 2 3 2 1 1 2 1 1 2 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 80 79 m 2H \| 76 75 m 2H \| 75 73 m 5H \| 39 38 ddd 2H J 58 85 123 \| 34 33 ddd 2H J 58 85 125 \| 32 32 p 1H J 59 \| 27 26 s 2H \| 22 21 ddt 2H J 58 84 126 \| 20 19 ddt 2H J 59 84 126	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)CN[C@H](CO)c1ccccc1	ir: 4 8 12 8 7 5 3 5 12 7 8 4 6 6 8 4 8 4 4 2 1 3 3 4 5 6 5 4 6 3 11 6 13 6 5 1 3 9 9 0 34 40 37 9 5 2 5 7 10 25 10 2 15 9 9 6 29 11 33 19 17 21 24 12 11 8 8 13 10 16 21 13 6 3 3 2 6 12 4 10 6 5 4 5 6 11 6 33 34 49 28 18 19 11 13 15 20 13 4 9 7 5 7 8 31 30 25 21 9 6 5 3 5 19 37 29 9 14 31 19 18 24 16 5 14 10 10 21 18 8 8 14 18 7 17 22 8 4 3 3 3 4 20 48 31 52 11 8 3 2 2 5 5 2 1 1 1 1 2 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 2 1 1 1 2 1 2 2 2 3 3 3 6 4 5 4 9 4 6 5 3 10 7 14 15 30 14 16 66 62 100 29 7 7 18 35 87 92 70 34 19 10 5 6 6 10 11 11 53 83 73 30 7 6 3 3 2 3 3 4 2 3 3 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 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 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 74 72 m 6H \| 41 40 m 1H \| 40 39 ddd 1H J 40 56 123 \| 37 36 ddd 1H J 38 55 121 \| 36 35 dd 1H J 48 169 \| 34 34 dd 1H J 48 168 \| 33 32 dt 1H J 49 79 \| 30 29 t 1H J 56 \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCC(=O)Nc1nc2ccccc2s1	ir: 3 2 1 2 2 2 1 4 3 2 9 2 2 2 1 3 3 1 1 2 3 2 4 4 4 3 1 3 2 1 1 2 2 1 1 2 2 1 2 2 2 2 1 53 3 2 3 6 8 17 5 3 6 2 3 16 3 15 14 4 2 1 2 3 2 1 4 18 3 3 2 2 2 1 2 3 2 1 4 3 4 2 2 2 2 8 2 2 1 2 2 2 1 1 2 2 2 2 3 2 1 2 2 2 1 2 3 2 1 2 2 2 1 2 2 2 4 2 3 2 1 2 2 2 2 2 2 2 1 2 2 2 3 23 6 2 2 2 2 2 2 4 2 3 2 1 2 8 64 13 100 0 1 4 3 0 1 3 4 7 2 3 2 1 2 3 2 1 2 3 2 0 2 3 2 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 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 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 2 2 2 2 1 2 6 5 1 9 43 8 3 2 5 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 2 4 11 30 9 9 3 2 2 1 2 2 1 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 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; 1HNMR: 77 77 dd 1H J 14 70 \| 77 76 dd 1H J 16 75 \| 73 72 td 1H J 14 73 \| 71 71 td 1H J 13 75 \| 42 41 s 2H \| 34 34 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCc1ccc(Nc2cc(CCc3ccccc3)ccc2C(=O)O)cc1	ir: 1 1 1 2 1 2 2 2 4 3 4 5 5 4 5 3 2 5 2 2 9 23 54 12 5 7 11 6 11 14 15 7 18 19 8 9 5 4 15 29 11 11 7 4 3 3 3 2 1 4 2 3 3 8 8 7 23 7 3 2 3 2 1 2 2 2 3 2 10 14 8 3 2 15 4 5 4 0 47 3 3 3 2 1 2 1 2 2 10 5 1 3 2 3 1 1 2 3 3 2 1 2 2 2 1 2 5 36 5 2 0 1 3 4 9 7 3 1 1 3 4 3 2 2 2 2 1 2 1 1 1 2 1 2 2 3 3 1 3 13 2 4 9 100 4 2 2 3 2 4 1 4 5 3 6 4 25 18 3 1 2 2 2 6 68 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 2 3 4 7 10 49 13 5 4 3 2 2 1 0 22 86 6 3 1 1 2 2 1 2 2 4 6 4 5 13 43 4 3 5 4 1 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 78 78 d 1H J 80 \| 73 73 s 1H \| 73 72 m 3H \| 72 71 m 4H \| 70 70 dt 1H J 9 20 \| 70 69 m 3H \| 29 28 m 4H \| 27 26 qt 2H J 9 73 \| 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.
CS(C)(=O)=NC(=O)Nc1cc(N)ccc1F	ir: 36 15 18 23 22 7 1 3 5 2 0 1 2 1 2 2 2 1 8 19 15 11 8 5 3 2 3 2 3 7 6 8 5 10 9 5 9 8 13 20 16 2 3 2 6 5 10 3 3 0 2 4 5 33 31 30 9 3 8 8 4 4 10 20 5 30 11 16 10 4 3 2 2 1 1 1 2 3 3 7 21 38 31 13 2 3 2 6 7 3 2 2 1 0 2 1 1 1 3 12 15 1 3 5 8 23 49 36 12 4 5 2 0 1 3 1 1 2 9 7 1 7 6 2 2 1 1 1 1 4 3 1 1 1 2 6 18 7 3 1 1 1 1 1 3 2 23 14 55 51 23 12 10 23 30 26 100 55 6 3 3 5 6 24 19 14 2 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 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 1 1 1 1 1 2 2 1 1 1 1 0 1 1 1 4 4 3 1 1 1 2 1 1 2 2 3 3 14 16 8 9 19 25 36 11 2 2 1 1 1 1 1 1 2 2 2 2 4 3 14 52 51 13 6 4 2 8 35 26 12 8 6 31 65 9 0 0 2 2 0 1 2 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 2 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 93 92 d 1H J 33 \| 73 73 dd 1H J 21 32 \| 72 71 dd 1H J 87 102 \| 66 65 ddd 1H J 22 36 86 \| 47 46 s 2H \| 31 30 q 3H J 13 \| 30 30 q 3H J 14	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C	ir: 1 1 1 1 1 0 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 1 1 1 1 1 3 1 1 2 1 1 1 1 1 0 1 2 3 3 14 23 9 4 3 2 1 1 0 1 1 0 0 1 1 1 1 1 0 1 2 1 1 1 2 0 0 1 1 2 1 1 0 1 0 1 1 1 1 1 1 1 0 0 0 1 1 2 1 1 1 1 0 0 2 7 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 1 0 1 1 1 1 1 1 2 2 1 2 2 2 1 3 1 2 3 1 2 1 1 2 1 0 2 6 14 100 15 7 2 2 1 1 1 1 1 1 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 0 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; 1HNMR: 41 41 d 1H J 55 \| 39 38 ddddd 1H J 26 35 49 59 99 \| 38 37 d 1H J 62 \| 36 35 dtdd 1H J 25 38 62 87 \| 35 34 m 2H \| 28 27 ddh 1H J 16 48 64 \| 21 21 d 3H J 15 \| 20 19 m 2H \| 19 18 m 3H \| 18 17 m 1H \| 17 16 m 6H \| 16 15 m 2H \| 16 15 m 1H \| 15 13 m 4H \| 9 9 d 5H J 158	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nnc(CCl)n1-c1ccc(Cl)cc1C(=O)c1ccccc1Cl	ir: 1 2 9 10 1 1 5 2 0 1 2 2 1 1 3 1 0 2 3 1 6 5 3 2 1 3 3 10 4 28 6 1 2 3 3 0 2 9 4 2 10 34 5 11 1 4 2 1 2 2 1 1 3 5 42 1 2 3 1 0 2 3 2 9 4 4 1 2 4 5 5 1 2 3 1 2 2 2 1 1 4 2 0 0 2 4 3 1 3 2 0 1 2 2 2 2 2 1 0 1 2 2 3 16 4 4 11 2 3 2 1 2 3 6 1 2 3 3 5 4 5 4 1 1 3 1 0 2 2 2 1 2 2 2 9 6 15 15 100 3 2 4 1 2 4 32 4 6 7 39 3 2 2 1 3 2 2 1 2 2 1 1 3 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 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 2 1 0 1 2 1 0 2 2 2 1 1 2 2 1 2 3 3 2 1 4 2 7 7 6 14 53 12 6 3 1 2 3 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 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 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 80 80 d 1H J 81 \| 79 78 d 1H J 25 \| 77 77 dd 1H J 17 74 \| 76 75 ddd 2H J 20 44 78 \| 75 73 m 2H \| 49 48 s 2H \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(-c2cc3ccc(Cl)c(F)c3[nH]2)cc1	ir: 3 6 7 17 11 12 21 8 4 12 21 18 8 9 36 8 15 11 7 5 2 3 6 18 13 3 9 8 13 22 62 12 11 3 2 3 3 5 10 5 4 2 2 2 3 5 20 4 3 2 3 3 11 48 100 86 20 11 11 7 4 3 2 2 1 1 1 2 2 2 4 6 6 26 41 8 3 3 2 2 2 13 3 1 2 2 2 3 2 1 2 2 2 3 2 2 2 35 27 3 4 5 7 60 18 3 0 2 4 6 1 3 6 6 29 63 2 8 14 10 3 6 7 55 37 9 4 6 7 4 4 3 2 2 2 2 3 4 6 40 6 20 38 83 18 16 26 10 5 9 52 12 23 13 9 3 4 16 30 4 3 4 2 2 2 3 2 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 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 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 3 2 1 1 1 1 2 3 2 2 3 4 6 6 8 19 20 100 49 99 30 16 8 5 5 5 3 3 3 2 2 2 2 2 2 3 4 4 2 2 3 8 16 36 54 12 10 5 4 2 2 2 1 2 2 2 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 2 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 91 91 d 1H J 40 \| 81 80 m 2H \| 77 77 dd 1H J 22 93 \| 76 76 m 2H \| 74 73 dd 1H J 49 93 \| 70 70 d 1H J 22 \| 39 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(CCc1ccccc1)OC1CCCCC1	ir: 11 4 2 2 1 3 6 6 8 14 24 10 3 5 5 1 2 5 7 2 2 3 4 7 17 8 3 4 8 13 17 9 11 18 14 13 5 6 17 29 92 99 38 14 13 9 7 1 2 4 5 19 11 11 6 4 3 3 4 3 3 4 2 2 6 15 4 4 18 13 3 1 2 4 3 17 5 26 10 3 3 2 1 1 2 2 1 1 3 19 5 2 9 9 3 4 7 22 5 8 10 15 8 2 4 2 2 2 3 3 11 27 24 39 25 8 5 5 10 6 3 17 29 14 23 10 4 6 6 5 3 4 6 21 28 22 19 6 5 2 3 7 22 71 95 62 17 8 8 2 2 7 6 2 2 2 1 0 1 2 1 0 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 1 1 1 1 1 1 0 1 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 1 2 3 2 3 5 13 5 12 12 13 7 10 5 5 13 27 43 61 46 100 54 59 17 3 4 3 5 2 4 2 1 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 73 72 m 6H \| 48 47 m 1H \| 30 29 td 2H J 11 86 \| 25 25 t 2H J 86 \| 19 18 dtd 2H J 51 62 162 \| 17 16 ddq 2H J 60 98 120 \| 16 14 m 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCOC(=O)c1nc(O)c2cc(-c3ccc(OC)cc3)sc2c1O	ir: 6 5 9 10 17 22 32 16 21 20 16 15 14 8 9 14 11 47 63 33 46 9 14 31 82 19 9 19 17 5 8 15 4 5 8 8 8 9 5 10 16 20 8 4 5 5 4 5 12 4 13 15 11 17 29 12 6 5 5 7 11 8 7 12 6 9 7 16 11 6 5 8 7 8 28 19 40 13 13 7 11 30 4 7 7 6 6 6 10 12 47 57 19 10 5 4 5 17 31 10 6 7 3 32 21 6 7 7 6 18 64 12 2 4 7 4 3 4 7 7 4 4 4 7 7 5 7 9 8 46 12 3 2 5 5 16 6 4 4 4 42 14 4 3 3 3 5 5 18 10 21 14 21 6 4 4 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 3 3 2 2 3 3 2 3 3 3 2 3 3 3 2 2 3 2 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 3 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 2 2 2 3 3 3 3 3 3 3 3 3 2 2 2 3 2 3 3 3 2 2 3 3 3 3 2 3 3 3 3 3 4 4 3 4 3 3 3 3 4 6 5 10 20 19 27 33 20 8 0 30 100 45 22 10 34 6 5 3 1 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 3 2 2 3 2 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 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; 1HNMR: 77 77 m 2H \| 74 74 s 1H \| 71 70 m 2H \| 44 43 t 2H J 64 \| 38 38 s 3H \| 18 17 p 2H J 67 \| 14 13 h 2H J 70 \| 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.
CC(C)N1CC(CCCl)C(c2ccccc2)(c2ccccc2)C1=O	ir: 2 1 1 1 1 1 1 1 1 1 2 2 2 1 2 1 1 1 1 1 2 2 1 3 11 2 2 1 5 3 3 15 11 18 42 8 5 3 2 6 11 18 26 4 2 1 1 5 2 0 1 2 1 0 1 4 3 1 3 2 1 0 1 2 1 2 2 2 2 8 11 3 6 5 4 3 1 2 4 3 1 5 3 3 1 1 1 1 1 1 1 1 2 2 1 2 0 1 1 1 1 2 2 3 3 2 3 1 1 1 4 2 7 5 3 3 2 4 4 5 2 3 4 5 4 11 5 3 1 2 4 3 7 11 9 23 6 2 1 1 2 2 4 4 16 20 12 3 6 27 2 2 3 40 7 2 2 1 1 1 2 3 2 1 1 2 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 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 2 2 3 3 6 7 8 20 18 100 26 14 7 3 3 2 2 3 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 74 73 m 6H \| 73 72 m 4H \| 40 39 hept 1H J 64 \| 37 36 dt 1H J 31 110 \| 35 35 dt 1H J 31 110 \| 30 29 m 1H \| 27 26 m 2H \| 22 21 ddt 1H J 29 63 127 \| 19 18 m 1H \| 12 11 dd 6H J 63 74	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NCCc1ccc(Cl)nc1	ir: 2 3 5 2 8 1 0 2 1 0 0 1 1 1 1 1 1 0 0 1 1 0 1 2 2 1 5 15 1 1 3 3 3 10 13 25 3 3 2 3 3 1 5 7 12 10 4 2 6 2 4 9 25 21 44 23 5 8 13 9 2 2 1 1 2 3 2 3 9 5 14 11 33 37 11 8 5 2 3 4 13 9 3 1 2 1 2 6 6 2 1 1 2 1 0 4 3 1 0 1 1 1 1 1 7 12 2 1 0 1 1 2 1 2 2 1 1 1 2 5 6 13 10 9 14 11 2 5 11 4 10 34 100 91 91 36 19 5 3 4 2 2 1 1 1 1 2 5 5 5 2 1 3 1 1 1 1 1 3 8 10 2 1 0 1 1 1 1 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 1 1 1 0 0 1 0 0 0 0 0 0 1 0 0 0 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 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 1 1 1 0 0 0 1 0 1 1 1 1 1 1 1 0 1 1 1 2 2 1 2 0 1 2 4 5 3 14 12 8 3 1 2 0 1 2 4 13 14 9 12 17 41 30 5 10 7 9 3 37 74 31 11 2 2 1 1 1 1 1 0 1 1 1 0 0 0 0 0 1 1 1 0 0 1 1 0 1 1 1 1 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 82 81 dt 1H J 9 20 \| 73 73 ddt 1H J 10 19 81 \| 71 70 d 1H J 79 \| 31 30 m 2H \| 29 29 m 2H \| 29 28 t 2H J 65	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNS(=O)(=O)N(CC(=O)c1ncn2ccsc12)S(=O)(=O)NC	ir: 9 6 5 2 1 2 2 3 3 2 2 2 3 1 5 5 4 9 3 1 3 2 2 2 3 2 2 1 6 6 5 5 2 1 4 6 11 7 6 1 2 3 4 5 4 21 4 12 3 1 0 2 2 2 3 2 2 2 1 1 1 0 0 0 0 0 0 1 0 1 1 2 4 8 4 9 38 19 11 3 2 2 2 1 2 1 2 5 1 5 24 12 4 4 6 9 37 100 2 2 4 2 0 1 1 1 1 1 2 0 1 1 1 1 0 2 3 4 7 7 3 3 2 1 3 2 1 1 2 2 0 1 2 5 1 1 1 0 1 0 0 0 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 2 2 0 0 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 1 1 2 1 2 2 2 3 2 3 2 3 1 2 0 0 1 0 0 0 1 1 0 1 1 2 3 3 2 9 3 3 2 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 72 m 2H \| 70 69 d 1H J 52 \| 60 60 q 2H J 69 \| 52 52 s 2H \| 28 27 d 6H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc2c(N)nc3c(c2n1CCCCNC(=O)N1CCOCC1)CCCC3	ir: 7 15 23 4 6 11 8 8 11 5 4 6 3 6 7 3 7 5 10 8 5 4 14 6 8 6 4 7 6 5 8 4 6 3 5 5 4 2 3 8 4 10 8 4 4 5 4 6 5 2 5 4 15 6 6 15 8 7 6 2 3 3 5 4 6 6 5 4 4 3 7 7 8 10 2 5 3 4 3 2 3 3 7 2 2 4 4 3 3 4 5 3 2 4 5 3 4 5 3 7 8 6 4 3 6 5 16 22 13 20 30 24 34 17 9 22 21 10 16 30 78 27 17 22 23 7 10 17 11 4 6 15 20 7 2 4 6 7 4 3 3 11 10 8 13 9 11 36 6 2 2 2 2 3 24 10 4 2 2 2 2 1 2 4 12 51 8 0 2 3 2 1 2 2 2 2 2 2 2 1 2 2 1 2 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 2 2 1 1 2 2 2 2 1 1 2 1 1 2 1 1 2 2 2 2 1 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 1 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 3 3 3 7 6 7 17 23 14 36 11 7 9 10 17 11 32 80 38 8 11 6 5 6 5 3 5 2 2 2 2 3 2 3 4 19 22 3 3 4 2 6 13 100 22 12 5 5 3 2 2 2 2 1 1 2 2 1 1 2 3 2 2 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 61 60 s 2H \| 58 57 t 1H J 55 \| 42 41 t 2H J 65 \| 37 36 m 4H \| 34 33 dd 4H J 44 52 \| 32 31 m 4H \| 28 27 m 2H \| 25 25 s 2H \| 19 18 m 6H \| 17 16 tt 2H J 52 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN1CCC(=C2c3ccccc3Sc3ccc(C(=O)O)cc32)CC1	ir: 1 1 3 2 1 2 2 1 9 7 7 2 1 1 4 3 2 1 2 4 4 26 38 4 1 1 1 2 1 2 2 1 1 0 2 2 1 1 1 1 2 5 31 3 2 3 5 1 1 1 1 1 1 4 9 6 1 1 4 1 1 1 3 1 2 4 2 2 2 2 2 7 4 2 4 13 4 4 20 32 11 2 1 1 2 6 2 2 1 2 5 5 2 1 1 1 3 10 2 1 1 1 1 1 0 1 4 2 1 1 1 2 1 5 3 3 11 1 2 2 1 1 1 4 7 3 2 3 2 1 1 1 3 1 2 1 7 11 3 28 2 2 6 32 3 2 2 5 8 10 2 2 4 1 1 1 1 1 1 0 1 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 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 1 1 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 1 1 1 0 0 1 1 1 1 2 1 1 1 1 1 1 2 5 6 6 29 14 23 3 3 2 1 0 1 4 100 50 1 0 1 1 1 1 1 1 0 0 0 1 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 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; 1HNMR: 82 82 d 1H J 21 \| 79 79 dd 1H J 21 74 \| 77 77 dt 1H J 7 74 \| 76 76 d 1H J 74 \| 75 74 m 2H \| 74 73 m 1H \| 28 27 t 4H J 45 \| 27 26 m 4H \| 23 23 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1cccc([C@@H](C)C2CC2)c1OCCl	ir: 2 1 0 1 1 1 1 3 1 1 0 1 1 0 0 0 1 0 0 1 1 0 1 1 1 0 0 0 0 0 0 0 0 2 1 1 2 13 2 9 3 3 5 2 4 3 3 5 100 12 4 12 2 0 1 1 1 0 3 1 1 1 3 1 3 10 14 5 5 4 2 2 7 4 3 1 2 7 1 1 1 1 8 2 1 2 6 10 2 1 1 1 3 6 9 3 1 1 3 2 2 2 3 4 1 5 4 8 12 14 1 13 1 2 3 1 1 2 4 5 4 5 7 3 1 3 2 1 3 10 5 1 1 1 1 1 1 1 7 50 22 11 3 1 1 2 1 3 3 4 3 4 1 2 1 0 1 27 0 1 1 2 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 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 1 0 0 1 1 0 3 1 1 1 1 5 9 3 6 3 6 12 11 8 17 8 11 26 86 7 8 2 6 1 1 1 1 1 0 1 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 0 0 0 0 0 0 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 1H J 10 79 \| 72 71 dt 1H J 9 82 \| 70 69 t 1H J 81 \| 57 57 s 2H \| 32 31 heptd 1H J 7 68 \| 28 27 m 1H \| 17 16 ttdd 1H J 15 46 62 77 \| 13 12 dd 6H J 34 67 \| 12 12 dd 3H J 15 55 \| 10 10 m 2H \| 8 7 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCCCCCC(C1=NCCN1CCO)C(C)C(=O)OCC	ir: 2 9 8 7 10 4 5 4 9 9 9 9 4 5 3 2 3 3 3 2 3 3 8 6 4 4 2 1 1 2 1 3 3 3 2 2 2 2 2 3 2 2 2 2 1 1 2 3 1 2 2 2 1 3 3 3 2 1 1 1 2 1 2 4 3 2 6 3 3 2 1 3 2 4 2 2 4 2 3 4 2 2 3 9 15 6 9 41 39 8 9 7 6 4 2 2 3 2 3 2 2 3 1 5 4 4 7 4 6 9 4 11 19 6 3 8 4 3 3 5 4 2 2 3 3 5 6 3 4 2 3 2 3 2 5 6 3 2 3 2 2 2 2 2 1 11 90 16 14 3 1 2 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 3 2 3 3 3 2 4 1 4 3 5 3 14 12 5 2 2 1 1 2 4 2 3 45 100 28 6 1 0 2 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 42 41 p 2H J 65 \| 37 37 m 2H \| 36 35 m 6H \| 36 35 dt 1H J 54 119 \| 28 27 m 1H \| 27 26 dq 1H J 75 99 \| 18 17 dtd 1H J 76 84 124 \| 15 13 m 2H \| 13 12 m 18H \| 12 12 dd 3H J 16 76 \| 9 9 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)CCc1cc2ccccc2c(=O)[nH]1	ir: 3 3 1 2 3 1 0 1 6 3 1 3 4 1 1 3 4 3 2 4 5 4 2 12 6 4 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 8 61 100 3 0 4 62 49 14 3 10 7 1 3 3 1 0 1 3 4 3 2 3 8 1 5 5 4 6 2 2 1 0 2 3 2 1 2 4 4 1 3 5 1 1 7 6 3 1 4 5 2 20 4 3 5 10 3 2 1 10 4 2 1 1 4 5 1 1 2 2 0 3 3 1 1 2 3 2 3 5 12 5 2 4 3 1 1 2 2 6 6 3 5 3 5 5 6 2 1 3 5 3 1 2 2 6 1 2 2 2 8 17 4 2 1 3 3 45 48 7 17 8 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 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 1 1 1 2 1 1 2 3 2 1 1 3 1 1 2 4 3 2 11 17 10 11 3 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 5 5 4 9 10 19 13 11 3 1 1 3 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 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 0 1 2 1 0 1 2 1 0; 1HNMR: 95 94 s 1H \| 79 79 dd 1H J 16 81 \| 76 75 dd 1H J 14 79 \| 75 75 td 1H J 15 80 \| 75 74 td 1H J 16 78 \| 68 67 t 1H J 14 \| 29 29 td 2H J 14 58 \| 28 27 t 2H J 57 \| 24 23 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1c[nH]c2c1C(=O)N(CCN1CCCCC1)CC2	ir: 12 19 12 3 1 5 3 1 2 6 2 2 1 3 4 1 0 5 36 7 6 7 3 4 2 3 3 4 2 2 2 1 2 5 5 2 2 3 2 3 4 9 79 22 33 7 7 19 47 24 6 0 2 3 7 1 2 5 6 4 10 6 6 2 2 3 8 5 7 28 3 10 8 14 2 2 3 3 2 27 37 11 5 4 21 35 7 2 2 2 3 3 2 2 2 5 5 4 6 7 88 13 10 11 11 11 32 5 5 3 9 5 6 13 8 3 5 4 6 25 32 9 5 6 10 8 3 5 6 8 4 13 3 4 1 3 3 13 15 15 11 2 1 2 3 1 2 3 8 6 5 4 41 2 1 4 3 5 100 4 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 2 4 4 3 3 5 4 3 3 2 3 12 12 6 4 1 2 5 28 10 8 2 1 1 2 2 1 2 2 2 1 1 1 1 1 2 2 2 3 4 12 30 34 21 3 3 6 3 2 2 1 2 2 2 1 1 2 1 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 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2; 1HNMR: 97 97 d 1H J 77 \| 66 65 m 1H \| 37 37 dd 2H J 37 44 \| 36 35 t 2H J 60 \| 29 28 m 4H \| 26 26 m 4H \| 25 24 d 3H J 7 \| 16 16 m 4H \| 15 14 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1CCC(OCC2CC2)(c2nc(-c3ccccc3)cs2)CC1	ir: 1 3 2 3 5 2 2 2 7 2 3 2 1 2 1 1 1 3 3 5 1 1 1 2 3 23 7 3 6 6 6 13 9 11 12 4 15 11 26 8 27 48 42 38 13 10 1 5 4 3 6 7 3 4 8 18 9 9 26 7 3 1 2 4 4 4 6 7 18 19 5 4 3 3 16 14 4 2 3 6 3 7 7 6 5 4 7 9 4 6 5 2 5 10 4 7 6 7 9 3 3 4 4 3 3 3 6 8 3 3 8 36 27 12 4 5 4 9 24 26 22 9 14 23 5 9 2 8 36 12 12 14 2 3 11 19 16 43 46 35 7 4 7 13 34 21 17 9 8 8 10 16 17 5 5 2 2 1 2 0 2 2 0 2 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 1 0 0 0 0 0 0 0 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 0 1 1 1 1 0 0 0 0 0 0 0 0 0 1 1 1 0 1 2 1 0 1 1 1 1 3 4 2 5 8 15 45 12 5 5 10 12 28 55 100 66 86 77 23 25 38 20 11 13 4 1 2 3 2 2 2 2 2 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; 1HNMR: 78 78 m 2H \| 76 76 s 1H \| 75 74 m 2H \| 74 73 ddt 1H J 13 66 79 \| 33 33 d 2H J 42 \| 28 27 ddd 2H J 57 83 152 \| 27 26 ddd 2H J 59 86 154 \| 25 25 ddd 2H J 59 86 154 \| 23 22 ddd 2H J 58 83 152 \| 13 12 pt 1H J 43 60 \| 5 5 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.
CCCCN1CCN(C(CN2CCC(N3CCCCC3)CC2)c2ccccc2)CC1	ir: 2 3 3 6 2 11 11 4 6 4 7 4 3 10 17 6 2 2 4 1 1 2 1 1 1 1 3 5 5 7 1 1 7 3 10 6 1 2 3 8 10 25 11 13 2 2 2 1 3 4 3 1 3 7 3 4 13 0 3 5 2 2 3 3 1 5 2 5 14 2 3 6 12 7 9 4 2 4 8 11 32 39 4 100 12 13 83 13 16 2 10 7 6 2 2 4 5 10 3 7 20 20 6 4 5 4 4 5 3 4 12 6 6 5 1 5 2 3 3 7 5 3 2 4 2 4 5 10 7 11 8 2 3 3 6 22 10 5 10 4 1 5 3 9 33 4 1 2 1 1 1 1 5 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 2 6 2 3 2 1 1 2 5 2 4 10 7 16 14 24 6 4 2 2 1 2 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 73 m 2H \| 73 73 s 2H \| 73 72 m 1H \| 38 37 t 1H J 55 \| 30 29 ddd 2H J 37 58 114 \| 29 28 m 5H \| 27 26 ddd 2H J 49 75 121 \| 27 26 m 5H \| 26 25 s 1H \| 26 25 m 6H \| 19 18 ddt 2H J 52 77 117 \| 16 15 m 6H \| 15 14 m 4H \| 14 13 h 2H J 72 \| 9 9 t 3H J 74	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(NC(=O)c1cccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1)c1ccccc1	ir: 2 2 3 3 2 2 4 3 22 11 5 8 4 4 6 5 4 5 21 8 3 2 4 3 3 3 4 3 6 3 7 13 3 8 4 7 27 8 5 11 64 44 25 33 14 19 60 1 8 12 3 2 3 4 30 11 3 2 2 1 2 2 2 3 3 2 4 6 8 7 3 2 2 2 3 3 2 3 3 2 2 5 3 2 5 24 4 3 4 5 24 3 3 2 5 5 2 7 5 3 2 3 16 4 3 2 2 3 4 30 7 8 25 5 7 3 3 3 2 3 2 3 5 3 9 6 5 12 16 8 15 5 2 4 5 8 9 3 3 10 23 35 13 47 25 49 17 7 27 19 37 5 19 10 9 2 2 5 3 2 2 3 2 2 3 6 2 2 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 1 1 1 2 1 1 1 1 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 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 2 1 2 3 2 1 1 3 2 1 2 3 2 0 4 6 7 0 25 100 22 11 3 0 3 4 3 1 2 5 2 2 2 2 2 3 2 2 2 3 5 4 7 44 27 7 83 25 8 3 2 1 3 3 2 1 2 2 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 85 84 t 1H J 21 \| 84 84 d 1H J 25 \| 82 82 s 1H \| 82 81 s 1H \| 80 80 dd 1H J 24 97 \| 80 79 ddd 1H J 13 22 79 \| 78 78 ddd 1H J 13 22 88 \| 77 77 dd 2H J 80 90 \| 74 74 m 2H \| 73 72 m 4H \| 17 17 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)S(=O)N=CC1CCCCC1	ir: 12 6 1 9 9 3 2 4 5 2 2 4 11 6 1 5 4 1 1 3 4 2 7 10 16 22 20 35 39 2 3 5 5 1 3 6 7 6 28 26 6 2 4 7 16 18 70 27 11 10 9 6 5 33 28 15 7 6 5 13 14 7 8 4 2 4 72 86 23 22 16 17 3 1 3 4 3 3 5 11 20 11 6 5 2 1 3 4 0 1 3 4 2 3 5 6 2 2 5 3 0 3 8 10 9 8 10 25 46 19 58 54 100 79 37 27 7 11 15 19 26 19 15 3 2 8 6 16 18 31 14 9 7 3 4 3 2 3 4 1 2 3 3 1 2 3 3 1 1 7 3 1 3 15 39 77 53 4 6 3 2 3 2 1 1 2 1 1 1 2 1 0 2 3 1 0 1 2 1 0 2 2 1 1 1 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 1 0 1 2 2 0 1 3 1 0 1 3 1 0 1 3 1 0 1 2 1 0 2 2 1 0 2 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 3 2 1 1 3 3 4 3 7 4 2 15 14 11 10 11 15 9 9 8 8 18 15 26 84 87 68 36 22 2 4 2 4 2 2 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 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 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 75 74 dp 1H J 9 83 \| 29 28 dp 1H J 50 82 \| 18 17 m 2H \| 16 14 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.
N#Cc1cccc2c(=O)[nH]c(-c3ccc(C(=O)N(CCO)CCO)cc3)cc12	ir: 5 4 5 5 4 4 9 9 6 9 3 8 8 13 6 11 13 10 17 11 13 9 17 4 4 6 8 4 3 4 4 3 2 3 4 6 5 4 6 4 6 5 5 3 2 24 69 11 5 4 6 3 8 12 5 3 3 10 2 2 3 4 6 2 2 3 3 2 2 2 3 3 7 2 2 2 2 1 2 2 2 2 2 4 6 4 3 2 3 3 13 20 24 15 27 34 64 20 13 12 5 5 2 3 2 2 3 2 2 2 2 4 5 3 4 2 2 2 3 6 9 7 6 18 8 6 4 5 4 6 5 4 17 5 6 4 4 3 2 3 15 4 2 3 10 15 6 4 5 17 13 7 5 5 10 13 5 1 1 32 89 9 2 0 2 6 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 3 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 2 2 2 3 2 2 2 2 2 3 3 4 6 17 30 23 9 8 33 100 69 54 13 8 6 2 1 2 4 2 1 2 3 2 2 4 3 12 28 31 11 4 2 2 4 4 2 2 2 2 2 2 2 2 2 1 1 2 1 1 1 2 1 1 1 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 1 2 1 1 1 1 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 100 100 s 1H \| 81 80 dd 1H J 14 75 \| 80 80 s 1H \| 79 78 m 5H \| 76 75 t 1H J 71 \| 42 41 m 2H \| 38 37 q 4H J 60 \| 36 35 t 4H J 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1nc2ccc(I)cc2c[nH]1	ir: 5 4 4 4 5 5 10 6 5 4 4 5 5 5 9 15 27 5 5 4 4 5 5 3 46 28 3 5 5 4 4 5 5 4 4 8 6 5 5 5 7 5 5 5 5 4 4 5 5 0 42 54 6 8 40 13 8 4 5 6 5 4 4 5 4 4 4 6 4 4 4 5 4 4 5 5 4 5 5 5 4 7 5 8 7 5 5 5 5 7 5 5 4 5 5 5 4 4 5 5 8 5 5 5 42 5 5 5 4 4 5 4 4 4 5 6 4 4 10 5 5 5 5 4 4 4 5 5 4 6 6 5 5 5 6 31 8 6 5 5 6 5 5 4 4 5 5 4 5 6 7 4 5 5 7 16 100 13 5 4 4 5 5 15 5 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 5 4 4 5 5 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 5 4 4 4 5 4 4 5 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 5 4 4 4 5 5 4 4 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4 5 5 5 8 7 11 16 7 10 8 5 4 4 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 6 22 25 6 5 6 5 5 5 5 5 4 5 5 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 5 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 5 4 4 4 5 4 4 4 5 4 4 4 5 4 4; 1HNMR: 85 84 d 1H J 22 \| 79 78 m 3H \| 77 76 d 1H J 81	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(CC)CC=Cc1ccccc1	ir: 2 4 4 6 7 2 3 2 2 8 19 2 2 3 13 3 0 1 1 1 0 1 1 1 0 1 1 1 2 17 10 4 1 5 2 0 0 4 7 36 55 18 4 6 7 2 6 3 1 2 4 1 1 2 2 2 6 2 2 1 1 1 1 2 3 2 2 11 6 13 3 3 9 14 14 6 28 44 12 3 7 9 3 4 100 63 16 12 0 2 4 5 15 3 4 2 1 5 7 9 17 23 15 5 1 3 6 4 0 1 2 2 1 2 2 2 2 2 7 5 2 4 4 10 3 4 6 5 11 12 6 4 6 9 7 7 34 5 2 5 18 9 35 43 18 7 5 2 2 3 3 5 32 12 3 1 1 1 1 0 1 1 1 1 3 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 1 4 2 2 0 1 2 2 1 2 4 4 2 5 10 27 14 69 91 92 30 23 8 5 2 2 1 1 4 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 74 73 m 4H \| 73 72 m 1H \| 65 65 m 1H \| 61 60 dt 1H J 44 146 \| 33 33 dd 2H J 13 44 \| 27 26 q 4H J 65 \| 11 10 t 6H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNc1nc(Cl)c(Cl)c(N2CCN(C(=O)OC(C)(C)C)CC2)n1	ir: 3 4 6 8 5 4 4 2 4 3 6 2 2 1 1 1 1 1 1 1 1 0 1 2 1 1 1 1 1 1 0 1 0 0 0 1 0 2 1 0 0 0 0 0 1 1 0 1 1 3 12 8 18 11 4 5 4 1 1 1 1 1 2 1 1 0 1 1 0 0 0 1 0 1 1 1 3 1 1 0 0 0 1 1 0 1 4 4 3 7 1 2 1 2 2 2 2 2 1 1 1 1 1 1 1 0 1 1 0 1 3 2 4 5 2 1 1 3 9 2 3 3 4 1 2 5 1 2 0 5 5 3 3 1 1 1 4 2 4 3 0 1 1 0 2 3 2 13 17 16 100 15 4 1 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 0 0 1 1 0 0 1 1 1 2 3 6 2 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 1 1 2 10 10 7 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 61 61 q 1H J 47 \| 38 37 dd 5H J 45 59 \| 36 36 dd 4H J 45 59 \| 31 30 d 3H J 48 \| 15 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C1CCN(Cc2ncc3cc(O)ccc3n2)CC1	ir: 1 1 1 1 4 3 5 4 1 3 2 4 2 2 1 3 3 1 0 1 2 1 4 0 0 1 1 4 0 0 1 1 1 9 1 0 1 2 1 1 2 1 0 1 0 0 1 2 1 1 1 2 2 1 3 5 7 1 28 1 38 4 2 2 3 2 1 1 2 3 1 0 1 1 1 1 1 1 0 2 1 16 100 12 3 5 1 1 1 1 0 0 1 0 0 2 2 2 2 4 2 1 1 2 2 6 3 1 2 3 1 17 8 4 2 1 1 1 2 3 1 0 2 1 1 1 3 2 4 1 1 1 0 0 0 1 1 1 0 2 2 16 11 2 14 1 15 1 0 32 9 4 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 2 1 1 2 1 0 0 1 2 2 1 4 2 3 26 3 5 2 1 1 2 2 21 7 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 92 92 d 1H J 17 \| 81 80 s 1H \| 79 78 d 1H J 85 \| 73 72 t 1H J 20 \| 71 70 dd 1H J 22 88 \| 41 41 s 2H \| 37 36 s 2H \| 31 30 ddd 2H J 54 81 123 \| 29 28 ddd 2H J 54 82 123 \| 26 25 p 1H J 58 \| 22 21 ddt 2H J 56 82 126 \| 19 18 ddt 2H J 55 81 125	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CNc2ccnc3cccnc23)cc1	ir: 10 9 10 10 12 13 10 14 11 12 11 13 15 13 12 17 15 18 24 18 28 20 14 13 18 12 14 46 31 20 23 21 19 15 13 22 15 12 12 15 19 17 11 11 15 13 12 10 10 11 12 13 16 16 20 18 12 11 11 10 12 11 10 16 21 13 11 10 10 13 10 8 19 49 13 12 10 9 10 11 10 10 16 11 9 11 15 11 11 10 10 10 10 11 27 17 12 13 11 13 9 10 10 9 11 9 10 10 13 12 0 100 4 12 15 11 11 17 17 15 10 22 18 11 9 12 12 10 9 10 11 11 11 15 16 32 27 16 12 21 16 12 13 13 20 42 40 17 17 20 18 12 14 12 11 21 12 10 10 10 29 16 31 11 10 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 10 10 9 9 10 10 10 10 11 12 17 23 36 59 15 11 11 10 10 10 10 10 9 10 10 10 10 10 11 11 14 11 11 11 11 15 17 28 66 17 19 30 14 12 10 9 10 9 9 9 10 10 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9 9; 1HNMR: 89 89 dd 1H J 21 45 \| 86 85 d 1H J 48 \| 83 82 dd 1H J 20 73 \| 78 77 dd 1H J 46 75 \| 73 72 dt 2H J 9 83 \| 69 68 m 3H \| 68 68 t 1H J 59 \| 47 46 dt 2H J 9 59 \| 38 38 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)S(=O)(=O)c1ccc2c(c1)C(Cl)c1ccccc1C=C2	ir: 14 9 28 25 13 12 37 50 7 8 3 21 42 11 14 9 6 4 16 17 5 4 6 19 21 6 5 5 11 12 2 6 6 5 14 40 13 12 19 23 34 54 9 38 40 6 4 9 7 2 3 6 4 26 61 61 7 5 5 16 31 9 9 29 11 25 45 25 20 14 11 7 4 3 6 5 3 3 7 5 10 16 6 14 91 33 16 56 100 43 35 87 16 24 10 6 5 7 13 5 3 5 16 16 5 6 9 5 1 2 6 3 0 3 6 3 0 4 6 6 7 12 26 46 23 6 8 3 2 4 5 3 2 7 12 14 5 17 17 6 3 12 28 25 28 5 6 4 9 24 7 4 4 6 8 6 6 5 3 1 3 8 3 3 8 5 3 1 3 5 3 1 3 5 3 1 3 5 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 4 4 2 2 4 4 1 2 4 4 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 0 3 5 3 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 4 4 2 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 2 5 4 2 3 6 4 2 6 7 11 12 79 66 53 13 13 9 5 2 4 4 3 2 3 4 2 2 4 4 2 2 3 4 2 2 3 4 2 2 4 4 2 2 4 3 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1; 1HNMR: 79 78 d 1H J 18 \| 78 77 m 2H \| 75 74 m 2H \| 74 74 td 1H J 14 77 \| 74 74 s 2H \| 73 73 ddd 1H J 15 73 82 \| 60 60 d 1H J 7 \| 28 28 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1ccc(-c2nc(Nc3cc[nH]n3)cc3ccccc23)cc1	ir: 2 7 10 1 1 1 2 1 1 2 1 1 2 5 2 2 2 5 11 28 1 3 2 2 2 8 4 1 1 4 5 41 72 16 3 4 5 3 1 4 3 2 6 100 21 5 2 3 8 3 2 3 2 3 5 5 11 4 3 2 5 5 6 2 2 4 4 8 16 10 2 5 4 2 1 3 3 6 1 1 1 1 1 2 4 6 4 4 2 2 1 12 2 2 1 1 3 10 39 8 2 3 10 4 2 2 1 16 1 17 5 3 3 5 0 8 1 2 4 3 3 14 4 3 2 2 2 2 2 4 4 16 9 6 2 3 2 3 2 11 58 4 4 11 4 3 16 19 13 16 10 2 1 9 4 21 21 9 46 4 4 1 4 11 2 0 2 24 3 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 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 1 2 1 1 1 2 1 1 2 5 3 5 11 8 22 48 43 15 13 30 5 3 3 1 2 2 1 1 2 2 1 1 2 3 1 2 6 11 2 4 22 57 93 4 6 2 4 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; 1HNMR: 94 93 s 1H \| 82 82 d 1H J 33 \| 80 80 m 1H \| 80 79 m 3H \| 78 77 m 1H \| 76 75 m 2H \| 75 74 td 1H J 14 75 \| 74 74 m 2H \| 64 64 d 1H J 14 \| 13 13 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1cc2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2cc1N	ir: 7 25 46 47 20 8 6 14 26 21 30 28 42 12 11 10 5 6 4 10 9 17 9 7 7 8 8 6 5 5 3 10 6 3 3 5 6 3 5 6 5 4 7 8 41 3 3 8 4 3 4 5 3 2 5 4 3 2 7 3 3 2 3 5 3 3 37 15 9 6 5 11 4 5 9 7 2 2 4 5 5 6 12 19 6 4 5 8 3 2 4 4 5 17 5 9 6 3 26 11 3 3 25 8 8 3 3 3 2 6 4 3 4 29 11 11 3 3 4 3 1 18 2 3 4 8 10 3 3 3 3 3 2 4 3 3 3 7 3 3 3 3 3 13 5 3 7 3 3 5 4 53 9 17 22 43 4 6 100 9 10 8 4 0 2 8 3 1 2 5 3 1 2 4 3 1 3 4 3 1 3 4 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 2 4 3 2 2 4 3 2 3 4 3 2 3 4 4 2 5 12 9 4 3 4 3 3 3 4 3 3 3 3 3 2 3 4 6 58 37 43 3 2 5 4 2 2 5 6 12 78 69 27 5 3 2 2 3 3 2 2 2 2 2 2 2 2 3 2 2 2 3 3 2 2 3 3 2 3 3 2 3 4 4 2 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 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; 1HNMR: 86 85 m 2H \| 82 82 d 1H J 17 \| 77 77 s 1H \| 74 74 d 1H J 18 \| 50 50 s 2H \| 48 48 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCOP(=O)(OCCCC)C(C)(O)CC(C)C	ir: 12 22 12 11 15 22 35 15 3 10 7 2 5 3 5 3 3 3 17 20 4 1 2 1 1 1 1 1 1 1 2 2 1 2 2 7 13 7 3 1 4 4 1 5 9 4 2 6 2 0 5 3 3 1 4 5 2 1 4 9 3 2 7 6 11 7 5 1 3 20 42 6 17 4 6 16 19 7 18 100 91 33 19 15 9 3 2 1 3 3 1 1 3 2 1 3 5 3 10 9 20 10 7 11 8 9 4 8 5 3 9 2 3 4 4 3 2 6 3 8 13 2 2 2 1 2 2 2 2 2 3 2 1 1 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 0 0 0 0 0 1 1 2 1 3 5 4 1 2 1 2 1 2 5 18 18 4 3 1 1 1 1 1 5 6 59 12 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 45 45 s 1H \| 40 39 m 5H \| 20 18 m 2H \| 17 16 m 5H \| 16 15 s 2H \| 14 13 h 4H J 68 \| 10 10 d 3H J 58 \| 9 8 m 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=S(=O)(c1ccc(F)cc1)N1CCOCC1	ir: 2 7 23 17 23 40 42 8 16 35 21 24 6 18 74 6 3 8 10 5 6 14 11 7 4 9 9 3 2 9 9 4 8 14 14 3 4 9 8 2 8 12 10 5 5 11 7 1 16 15 11 0 7 96 39 21 56 7 8 2 21 15 11 10 12 15 16 2 13 20 12 7 14 14 20 0 16 40 60 31 26 37 73 11 55 14 11 33 9 39 7 6 13 11 6 13 27 33 22 17 11 8 3 6 9 6 2 5 10 6 2 5 11 7 2 7 13 6 2 8 10 7 3 9 15 16 5 7 8 5 5 11 10 7 3 7 8 4 3 7 8 4 4 8 9 15 53 58 15 7 11 10 7 4 5 8 7 3 5 10 9 4 5 9 6 2 5 9 6 2 5 9 5 2 6 9 5 2 6 9 5 2 6 8 5 3 6 8 4 3 7 8 4 3 7 8 4 3 7 7 4 4 8 7 3 4 8 7 3 4 8 6 3 4 8 6 3 5 8 6 2 5 9 6 2 5 9 5 2 5 9 5 2 6 8 5 2 6 8 5 3 6 8 4 3 6 8 4 3 7 7 4 3 7 7 4 4 7 7 4 4 7 7 3 4 8 7 3 4 8 6 3 5 8 6 4 6 9 6 3 6 9 7 8 8 100 23 20 42 16 13 3 9 11 6 3 7 8 5 3 6 8 5 3 6 8 4 4 7 7 4 4 7 7 4 4 7 7 4 4 7 7 3 4 8 6 3 5 8 6 3 5 8 6 3 5 8 6 3 5 8 5 2 5 8 5 3 6 8 5 3 6 8 5 3 6 8 5 3 6 7 4 4 6 7 4 4 7 7 4 4 7 7 4 4 7 7 4 4 7 6 4 5 7 6 3 5 7 6 3 5 8 6 3 5 8 6 3 5 8; 1HNMR: 78 77 m 2H \| 72 71 m 2H \| 37 36 dd 4H J 54 61 \| 30 30 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1c([C@@H](O)CN2CCC3(CC2)CCN(c2cnc(S(C)(=O)=O)cn2)C3=O)ccc2c1COC2=O	ir: 0 22 13 5 5 4 7 18 7 9 6 8 31 5 5 17 10 3 6 3 3 2 3 2 2 3 5 5 3 4 3 12 22 19 41 13 4 4 67 15 11 4 10 59 8 3 4 3 4 2 3 4 4 3 5 20 6 11 3 10 7 6 8 2 16 22 40 12 4 11 41 23 11 7 8 19 6 9 10 12 30 16 18 45 60 37 31 12 27 19 19 13 27 8 18 11 5 4 8 8 5 22 16 24 28 34 17 5 8 5 9 9 7 7 1 5 6 26 11 22 20 17 5 10 10 5 4 9 16 19 5 5 3 15 4 5 7 4 4 10 72 16 7 4 3 3 7 12 4 100 15 5 3 8 11 2 2 2 2 28 16 3 2 3 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 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 3 3 2 3 3 3 3 4 3 4 7 3 5 6 6 6 6 25 19 8 8 19 24 40 11 19 22 20 11 6 2 5 6 9 73 55 8 6 4 3 2 2 2 3 4 5 4 2 3 3 4 4 6 8 3 3 2 2 3 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; 1HNMR: 83 83 s 1H \| 81 80 s 1H \| 78 78 d 1H J 90 \| 72 71 m 1H \| 53 53 s 2H \| 49 48 dtd 1H J 7 50 57 \| 39 38 m 3H \| 34 34 s 2H \| 32 31 dd 1H J 50 120 \| 30 29 ddd 2H J 41 69 124 \| 29 29 dd 1H J 49 119 \| 28 27 ddd 2H J 41 69 125 \| 24 24 s 2H \| 22 22 ddd 2H J 42 69 128 \| 20 20 m 2H \| 19 18 ddd 2H J 40 68 126	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cnn(-c2ccc(C=CC=O)cc2)c1	ir: 5 2 0 2 5 3 3 5 17 25 17 6 7 6 8 4 18 12 7 3 4 6 2 2 4 1 1 1 1 1 1 2 1 2 1 3 14 3 1 2 1 1 1 2 1 0 2 2 5 4 2 3 11 24 28 10 4 4 15 27 30 15 5 14 8 19 25 18 5 23 10 5 5 12 24 12 2 1 3 4 4 2 5 7 40 21 6 11 1 3 4 11 10 6 3 3 12 18 24 9 18 15 52 38 3 13 17 6 2 2 3 3 3 3 3 1 1 3 3 5 2 5 8 16 17 11 21 22 38 43 16 22 16 17 13 9 4 3 2 3 3 3 4 3 5 18 46 15 33 18 45 23 8 38 3 4 2 2 1 2 2 2 1 2 1 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 10 2 2 1 2 3 3 3 4 6 5 6 12 11 14 92 100 79 42 26 38 26 18 10 6 4 2 5 4 3 6 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 97 96 dd 1H J 13 70 \| 78 77 m 2H \| 77 77 m 2H \| 76 76 dd 2H J 9 72 \| 75 75 m 1H \| 66 65 dd 1H J 71 158 \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CC(CC(=O)OCC)OC(=O)OC(C)Cl	ir: 30 10 8 13 18 9 6 5 16 11 20 19 3 11 9 8 4 3 1 1 1 1 1 1 1 1 2 5 11 6 5 1 1 1 1 1 1 1 1 1 1 2 3 3 2 6 2 2 1 2 4 4 3 1 3 4 1 2 1 1 1 2 1 3 1 2 2 4 2 7 4 2 3 9 5 2 3 5 2 9 2 3 2 1 1 1 1 1 1 1 1 1 4 4 8 3 3 5 4 3 2 3 2 2 3 3 12 25 24 5 5 14 8 4 11 7 7 7 9 10 30 4 11 5 8 6 5 8 5 11 8 6 8 6 5 8 3 1 0 2 3 1 7 21 90 10 49 100 0 4 2 0 0 2 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 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 1 2 3 3 3 8 10 4 3 4 5 9 11 27 7 6 3 2 1 2 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 65 65 q 1H J 52 \| 61 60 p 1H J 76 \| 42 41 q 4H J 66 \| 31 30 dd 2H J 76 173 \| 28 27 dd 2H J 76 173 \| 19 18 d 3H J 53 \| 13 12 t 6H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C(=O)OC(C)(C)C)c1ccc(N2Cc3ccc(Br)cc3C2=O)cc1	ir: 7 8 8 4 8 5 7 7 5 5 7 15 8 12 5 4 4 5 3 3 4 2 4 3 3 2 3 4 4 9 4 4 5 2 3 3 4 3 5 8 52 20 7 0 2 4 3 3 3 3 7 10 7 27 11 80 33 7 3 6 4 4 5 2 3 3 3 10 8 5 4 3 6 3 2 3 7 3 2 2 9 2 4 19 4 3 3 6 6 6 22 5 4 8 5 3 5 9 4 3 3 10 2 4 10 6 5 3 3 2 3 5 7 8 8 4 5 6 8 11 8 7 8 6 10 7 4 7 10 15 43 10 4 3 3 2 4 31 3 2 2 3 4 6 62 9 6 26 11 51 10 6 10 7 20 27 6 2 2 3 3 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 3 3 4 3 2 3 3 4 4 4 4 6 7 8 14 16 9 11 100 17 10 8 5 3 3 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 80 80 d 1H J 24 \| 75 74 dd 1H J 25 85 \| 74 73 m 3H \| 72 72 m 2H \| 50 50 d 2H J 9 \| 38 37 m 1H \| 15 14 d 3H J 71 \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(C=O)c(OCc2cccnc2-c2ccc(Cl)cc2)cn1	ir: 1 2 2 2 1 3 6 29 7 2 2 3 3 3 6 9 2 3 3 3 14 9 5 5 7 2 2 3 4 3 3 4 4 3 2 2 2 3 20 9 16 2 4 2 1 4 5 3 2 2 2 1 2 3 9 57 7 3 3 3 3 9 9 7 3 4 3 25 15 4 2 3 2 2 2 2 1 1 1 1 1 1 2 11 1 3 9 4 2 2 1 3 2 1 2 1 2 5 2 1 1 1 1 5 3 2 5 14 7 1 1 2 3 2 2 1 1 1 2 4 5 27 10 6 1 2 2 3 3 18 7 2 2 2 2 2 8 2 7 4 6 18 3 2 32 3 4 11 16 1 3 7 8 5 5 2 15 1 1 3 4 100 3 0 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 2 1 1 1 2 2 2 1 2 7 39 28 14 9 5 3 3 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 1 1 1 1 1 1; 1HNMR: 86 85 dd 1H J 21 43 \| 78 78 s 1H \| 77 77 m 2H \| 76 76 ddt 1H J 9 20 77 \| 75 74 m 2H \| 73 72 dd 1H J 43 76 \| 72 72 s 1H \| 54 53 d 2H J 10 \| 40 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc(C#CCN2CCN(C)CC2)cc2c1C(=O)N(Cc1ccc(Cl)cc1)C2	ir: 0 3 12 3 6 4 6 3 4 4 3 6 3 4 2 3 6 7 3 6 2 1 2 5 11 37 7 6 17 2 3 0 1 2 4 6 2 3 5 5 7 3 20 6 7 5 5 7 3 2 5 9 6 5 20 67 8 8 2 6 3 1 13 5 15 25 10 5 7 11 8 8 3 3 1 1 7 6 1 83 3 18 7 7 23 19 7 2 3 4 3 2 3 11 13 6 8 8 12 19 8 24 7 4 3 2 4 1 1 1 1 1 2 2 7 5 6 22 5 5 3 4 4 6 4 2 4 2 2 3 3 13 6 1 2 2 15 14 2 1 1 1 1 1 1 8 30 20 5 3 2 0 32 1 2 3 32 1 1 5 10 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 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 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 3 2 3 2 1 1 1 1 3 3 11 15 13 32 100 30 7 6 3 3 2 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 74 73 m 6H \| 72 72 d 1H J 26 \| 47 47 d 2H J 9 \| 44 44 d 2H J 10 \| 41 40 s 2H \| 27 27 m 4H \| 27 26 m 4H \| 24 24 s 3H \| 24 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)CBr)cc2)cc1	ir: 6 7 8 4 3 3 7 4 5 15 27 24 8 8 9 10 16 17 5 7 4 6 6 17 22 15 8 10 8 8 9 12 11 10 9 11 8 3 6 12 9 6 4 6 8 0 19 10 9 1 3 5 11 20 9 3 17 61 45 12 3 8 3 21 19 6 1 1 4 11 2 0 1 2 1 0 2 4 4 1 2 18 8 62 100 4 4 7 8 4 2 4 7 23 38 2 2 3 3 10 35 30 31 8 3 2 0 1 2 1 0 2 3 12 10 6 6 12 7 11 10 3 5 21 26 26 5 7 9 27 16 10 3 0 2 2 3 1 0 6 7 14 38 8 1 6 8 5 5 3 17 63 33 7 2 1 1 1 1 1 2 1 1 8 1 1 1 1 1 1 1 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 0 0 0 1 0 0 0 1 1 0 1 1 1 0 1 1 0 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 1 1 1 1 1 1 2 2 2 3 2 1 1 2 2 3 6 15 19 45 51 26 8 6 2 2 2 2 2 1 2 1 1 1 1 1 1 1 2 2 1 1 1 3 5 1 60 60 42 14 4 1 1 2 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1; 1HNMR: 79 78 m 2H \| 77 77 m 2H \| 74 73 m 4H \| 70 70 s 1H \| 46 46 s 2H \| 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.
O=C(c1c(-c2ccccc2)nc2ccccn12)N1CCN(c2cccc(CO)c2)CC1	ir: 3 1 1 2 4 1 1 2 2 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 1 1 4 1 2 2 7 7 16 3 1 3 5 12 5 2 7 25 8 11 39 8 7 6 4 2 2 1 0 1 3 1 0 1 2 1 1 3 2 2 1 5 6 11 10 7 4 1 4 1 2 1 9 3 2 3 3 5 5 7 23 3 15 10 11 10 9 3 3 4 3 3 5 5 3 2 5 4 1 1 1 1 1 1 15 1 3 3 3 10 3 2 2 1 1 1 2 2 2 1 2 2 1 1 1 1 3 2 1 2 6 4 2 10 5 6 11 8 7 46 3 3 4 8 7 13 4 20 7 2 3 25 2 2 1 1 2 5 3 1 1 1 1 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 2 5 3 4 3 4 2 1 4 5 2 13 21 62 40 13 25 15 5 3 11 100 46 10 2 1 2 1 1 0 0 1 0 0 1 1 1 1 3 2 1 2 2 2 2 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 93 92 dd 1H J 13 82 \| 79 78 m 2H \| 78 77 dd 1H J 14 81 \| 77 76 ddd 1H J 13 70 81 \| 74 74 tt 1H J 14 74 \| 72 72 dd 1H J 75 82 \| 72 71 ddd 1H J 13 70 82 \| 71 70 ddq 1H J 10 21 82 \| 70 70 ddd 1H J 12 21 75 \| 69 68 m 2H \| 67 67 tt 1H J 9 22 \| 46 45 dt 2H J 9 57 \| 39 38 m 4H \| 33 33 m 4H \| 25 25 t 1H J 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)c1ccc(NCC(F)(F)F)nc1	ir: 11 11 11 8 7 4 4 8 9 7 11 10 10 8 3 9 7 3 3 4 4 2 4 3 3 2 3 4 5 8 4 4 5 5 10 10 34 27 4 4 3 4 3 2 3 2 3 4 3 2 2 14 24 24 15 3 3 4 2 3 2 3 2 2 3 3 3 4 4 8 17 16 5 3 4 4 3 3 4 2 2 2 2 2 2 2 2 2 2 3 9 3 4 3 2 3 2 3 8 5 8 9 6 4 4 8 8 8 11 6 4 3 2 2 3 3 4 4 5 6 5 8 16 19 30 27 16 9 6 4 3 3 3 4 7 3 3 9 100 50 7 6 8 29 6 4 3 3 3 2 3 2 12 28 18 7 4 1 2 5 4 6 38 0 2 4 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 3 4 5 3 2 2 3 3 4 4 5 9 8 13 11 9 4 4 4 3 2 3 3 3 2 2 2 2 2 2 2 3 4 4 4 5 8 23 48 32 22 22 6 4 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; 1HNMR: 87 86 d 1H J 19 \| 81 80 dd 1H J 18 81 \| 73 72 tq 1H J 12 50 \| 69 68 d 1H J 80 \| 42 41 qd 2H J 51 130 \| 27 26 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CN2C(=O)[C@@H](C(C)C)NS2(=O)=O)cc1	ir: 0 0 1 1 0 1 1 1 1 1 1 1 1 2 3 3 6 3 3 1 1 1 1 1 1 4 1 0 1 1 1 1 1 1 1 5 2 5 2 2 1 0 1 1 1 3 4 1 2 1 1 1 1 2 6 6 8 8 4 2 4 13 16 3 3 8 1 2 1 1 1 2 2 2 1 1 2 1 1 1 1 3 2 2 3 2 4 5 27 22 2 1 1 1 1 3 4 2 5 5 2 2 5 16 14 6 5 2 5 6 1 2 4 1 1 4 8 11 7 3 4 1 1 1 1 2 2 1 1 1 1 0 3 2 1 0 0 0 0 0 0 0 0 0 0 0 1 5 23 24 2 1 2 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 0 1 1 0 1 2 2 0 6 4 2 2 1 1 1 1 0 0 0 0 0 0 0 0 0 1 1 1 2 5 94 100 9 2 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; 1HNMR: 73 72 dt 2H J 9 86 \| 68 68 m 2H \| 68 67 d 1H J 84 \| 50 49 m 2H \| 39 38 ddp 1H J 15 59 87 \| 38 38 s 2H \| 21 20 dp 1H J 66 74 \| 10 9 ddd 6H J 15 66 214	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1ccc(Cl)c(O)c1	ir: 0 4 11 4 2 6 9 5 1 5 8 6 4 10 11 7 2 6 8 2 19 13 14 9 1 7 7 5 5 8 7 2 3 7 6 4 5 8 5 1 3 7 5 1 3 7 5 2 4 10 13 7 16 100 82 26 9 5 4 2 5 7 4 2 6 15 18 26 14 12 4 7 18 13 9 7 17 32 24 36 29 15 53 80 70 19 15 5 10 9 21 20 14 9 3 16 7 5 2 5 9 16 7 4 7 7 3 5 7 5 1 4 7 4 2 8 10 14 13 18 10 5 4 5 7 4 1 5 7 6 8 15 12 4 2 5 6 3 2 6 18 10 5 6 5 2 3 8 36 31 6 8 10 11 8 8 5 2 3 6 6 6 5 7 4 1 4 7 4 1 4 7 4 1 4 7 3 1 4 6 3 1 4 6 3 1 4 6 3 1 5 6 3 2 5 5 3 2 5 5 2 2 5 5 2 3 6 5 2 3 6 5 2 3 6 4 1 3 6 4 1 3 6 4 1 4 6 4 1 3 6 4 1 4 6 3 1 4 6 3 1 4 6 3 1 4 6 3 2 4 5 2 2 5 5 2 3 6 5 2 3 5 5 3 4 6 5 2 6 10 6 3 3 6 5 2 5 7 5 2 5 10 12 8 16 11 33 43 23 20 7 6 6 11 88 99 79 4 5 4 5 5 3 3 4 5 3 2 4 5 3 2 5 5 3 3 5 5 3 3 7 6 3 3 5 5 2 3 5 4 2 3 5 4 2 4 6 4 2 3 6 3 1 3 5 3 1 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 3 2 4 5 2 2 4 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 4 2 3 5 3 2 3 5; 1HNMR: 72 72 d 1H J 81 \| 70 69 dd 1H J 20 81 \| 68 67 dd 1H J 10 21 \| 64 64 s 1H \| 29 28 dtt 1H J 9 66 132 \| 13 12 d 6H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(S[C@@H]2SC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc(OC)c1OC	ir: 4 3 2 6 1 2 1 2 2 4 10 2 3 5 3 2 2 8 3 10 10 4 1 5 6 78 64 59 5 4 3 2 3 2 3 6 3 1 1 2 2 2 1 1 1 1 3 7 3 4 2 4 6 2 4 1 2 1 2 1 3 5 8 4 13 26 29 94 11 72 46 16 12 12 6 15 4 5 7 7 3 4 2 1 2 2 2 4 13 4 4 5 15 5 2 3 8 4 3 35 100 58 13 11 5 4 6 7 8 7 7 5 1 5 8 3 12 8 8 10 17 29 14 23 18 27 21 9 5 14 5 4 1 2 2 1 1 2 8 3 0 3 4 2 66 49 7 3 1 2 1 1 1 1 3 7 8 4 4 2 46 4 2 1 1 1 1 0 1 1 1 0 1 1 1 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 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 1 1 1 2 1 1 2 2 4 5 6 4 3 4 4 6 4 11 14 8 15 13 56 26 17 23 27 27 13 4 7 2 3 1 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 66 66 s 2H \| 55 54 td 1H J 27 74 \| 53 52 m 2H \| 46 46 dd 1H J 24 72 \| 39 38 d 9H J 71 \| 34 33 dd 1H J 22 138 \| 31 30 dd 1H J 49 137 \| 21 20 m 9H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1ccc(-c2ncn(-c3ccc(OC(F)(F)C(F)(F)F)cc3)n2)cc1	ir: 12 10 6 8 7 5 4 5 8 4 2 4 2 3 6 2 1 5 7 2 1 2 3 2 2 3 3 3 4 2 2 5 7 6 5 2 3 3 2 1 1 2 4 3 2 2 3 1 3 4 2 2 5 12 37 22 11 4 4 1 2 5 2 0 5 22 14 1 3 20 3 1 1 2 1 2 4 2 4 4 2 2 1 1 2 3 3 5 7 14 4 6 34 20 6 2 2 2 1 1 2 1 0 1 3 2 18 1 3 1 1 2 2 1 0 2 3 5 2 2 3 2 1 2 3 3 1 2 3 7 1 2 2 1 0 2 2 1 5 20 3 1 1 2 2 1 5 21 7 0 9 18 5 3 5 8 71 100 12 1 2 2 2 7 10 2 2 2 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 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 2 1 1 2 3 2 2 2 2 3 3 5 10 21 27 18 12 9 3 2 2 2 1 1 2 1 1 1 2 1 1 4 22 35 10 2 1 1 1 2 2 2 4 4 18 44 42 5 7 3 2 2 2 1 1 2 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 87 87 s 1H \| 79 79 m 2H \| 77 76 m 2H \| 73 73 m 2H \| 68 68 m 2H \| 45 44 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc([C@H]2C[C@@H]2COc2cc(NCc3ccc(Cl)c(C)n3)c(=O)n(C)n2)nc1	ir: 1 3 2 5 6 2 7 7 7 5 1 8 5 5 5 7 8 13 11 13 30 12 9 8 3 2 2 3 7 5 23 9 6 2 10 3 4 12 3 5 3 8 3 2 2 2 2 3 3 5 6 7 7 8 22 16 4 3 2 2 5 3 2 5 1 2 2 3 6 5 8 10 3 8 12 11 5 2 1 1 1 1 1 14 1 2 5 3 1 2 2 5 4 2 6 5 6 2 1 8 2 2 3 2 1 0 2 1 9 2 1 1 2 1 5 6 12 7 100 18 75 16 9 7 5 3 0 2 5 6 2 6 17 63 8 5 12 37 7 5 4 20 75 35 22 20 10 2 6 36 13 15 18 98 10 3 1 4 3 9 2 1 10 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 2 3 1 2 2 1 2 3 5 7 12 11 22 21 24 29 8 8 3 2 1 1 1 1 1 1 0 0 0 1 0 1 1 4 5 8 28 29 80 43 11 2 5 2 3 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; 1HNMR: 87 87 t 1H J 58 \| 81 80 d 1H J 20 \| 76 76 d 1H J 81 \| 74 73 dt 1H J 9 80 \| 73 73 dd 1H J 6 82 \| 71 70 dd 1H J 18 82 \| 60 60 s 1H \| 45 44 m 3H \| 42 42 dd 1H J 54 100 \| 39 39 s 3H \| 37 37 s 3H \| 27 26 m 1H \| 24 24 s 3H \| 18 17 tdt 1H J 53 82 95 \| 16 15 td 1H J 59 94 \| 13 12 ddd 1H J 68 83 93	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)CNS(=O)(=O)c1ccc(F)cc1	ir: 1 0 1 1 0 1 4 9 4 2 6 16 4 2 1 1 0 0 0 0 0 1 10 0 0 0 0 1 1 1 0 3 6 0 0 1 1 0 1 1 1 2 5 2 5 3 1 2 1 1 3 4 5 4 16 2 2 0 2 2 5 15 1 0 3 4 13 21 8 3 8 3 1 0 1 1 1 3 2 1 1 17 5 6 18 1 0 1 1 1 1 1 1 1 1 2 9 3 4 2 2 3 5 24 45 23 11 16 7 4 7 2 1 2 1 1 2 1 2 1 1 1 1 10 2 2 3 1 1 1 2 1 2 4 2 0 1 0 0 0 0 0 1 0 0 2 5 1 1 1 0 1 1 0 0 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 0 0 0 0 1 1 0 1 1 3 2 3 6 3 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 4 5 27 100 13 4 2 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 79 78 m 2H \| 73 72 m 2H \| 58 57 t 1H J 75 \| 31 30 dd 2H J 49 75 \| 19 18 dtt 1H J 50 63 127 \| 9 9 d 6H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccccc1C(=O)Nc1cc(S(=O)(=O)Cl)cc2c1CCCC2	ir: 0 2 5 3 2 5 7 14 5 6 7 6 4 4 4 5 12 9 5 3 10 21 14 8 11 4 7 4 3 10 22 10 15 11 6 5 5 10 16 54 18 40 22 4 6 7 10 2 3 5 10 5 4 3 4 2 4 6 3 0 3 5 10 9 14 27 15 16 8 7 7 4 3 4 2 1 3 4 2 2 3 6 9 51 50 7 5 2 3 5 5 6 5 6 3 6 14 23 21 5 4 3 1 2 5 4 4 4 5 3 7 7 11 4 3 5 7 5 4 4 4 2 1 8 17 16 8 9 8 6 2 4 4 2 2 9 69 14 12 13 6 26 16 50 19 16 8 6 6 8 6 19 9 4 3 5 4 6 8 12 7 30 5 6 3 1 2 4 3 1 2 4 2 1 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 1 2 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 1 2 3 3 1 2 3 3 1 2 4 3 2 2 5 4 3 3 4 3 1 3 7 5 12 9 4 38 100 20 18 7 3 3 4 2 2 3 4 2 2 3 3 2 2 4 3 3 5 4 11 29 44 30 7 3 4 4 4 2 2 3 3 1 2 3 3 1 2 3 3 1 2 4 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3; 1HNMR: 79 78 d 1H J 22 \| 77 76 dd 1H J 16 80 \| 75 74 dt 1H J 8 18 \| 74 73 td 1H J 17 77 \| 73 72 m 2H \| 29 28 m 2H \| 28 27 ddt 2H J 10 64 73 \| 24 24 d 3H J 7 \| 18 17 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCN(CCC)CCCCCOc1ccc(C(=O)OC)cc1	ir: 6 6 16 8 10 10 8 5 2 3 6 5 6 15 43 12 3 3 3 1 0 1 1 1 1 3 7 1 2 1 2 1 5 21 3 1 2 1 1 2 4 3 1 2 1 3 2 2 4 1 1 3 1 7 13 43 22 5 5 6 8 8 9 3 6 5 3 4 6 2 11 3 4 9 11 5 3 1 4 9 2 4 8 17 18 17 13 9 6 4 4 3 3 2 2 4 3 2 4 4 3 4 2 5 6 4 4 5 6 6 3 2 8 7 7 56 21 10 18 13 7 12 10 4 9 12 9 4 3 1 1 1 2 1 3 1 3 5 5 6 5 7 4 30 12 3 2 1 4 9 23 32 12 4 2 2 1 0 0 1 1 1 3 3 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 1 0 1 4 1 4 4 5 5 4 3 3 2 2 4 3 6 27 22 24 100 19 3 2 2 1 2 1 1 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 78 78 m 2H \| 70 70 m 2H \| 40 40 t 2H J 63 \| 39 39 s 2H \| 25 24 t 4H J 64 \| 24 24 t 2H J 61 \| 18 17 ddd 2H J 63 73 134 \| 16 14 m 8H \| 9 9 t 6H J 79	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1NC(=CC(=O)N2CCCCC2)Sc2ccccc21	ir: 0 3 5 4 2 6 5 6 3 4 7 3 1 4 7 8 4 7 10 14 2 4 5 1 3 5 6 12 2 5 5 2 2 6 5 9 4 9 11 68 26 13 8 19 13 5 6 5 7 7 8 6 18 19 9 8 13 36 43 54 22 14 6 7 4 5 3 3 5 6 3 2 3 4 3 3 5 3 2 7 7 4 4 2 4 9 8 3 4 4 2 2 4 4 3 3 5 4 2 3 6 4 3 3 5 5 12 16 10 10 22 15 10 14 5 14 12 10 8 11 6 12 12 13 18 4 3 4 5 6 9 14 7 6 4 7 20 7 5 4 9 4 5 11 8 3 2 15 100 36 6 6 6 3 4 7 6 15 72 51 60 59 94 23 7 3 4 5 5 2 3 4 3 1 3 4 2 1 3 4 3 1 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 2 3 3 2 2 4 3 2 2 3 3 2 2 4 3 1 2 4 3 1 2 4 3 1 2 4 3 1 2 4 2 1 2 4 2 1 2 4 2 1 3 4 2 1 3 4 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 3 4 3 3 4 5 4 2 4 5 7 9 15 28 36 61 27 13 7 4 6 5 3 2 3 4 3 2 4 4 3 3 4 4 5 4 10 10 23 38 42 16 11 8 7 5 3 3 4 4 3 3 5 3 2 2 4 3 1 2 4 3 1 2 4 2 1 2 4 2 1 2 4 2 1 2 4 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 1 2 3 3 1 2 3 3 1 2 3 2 1 2 3; 1HNMR: 80 80 dd 1H J 15 76 \| 77 76 td 1H J 16 72 \| 76 76 dd 1H J 18 72 \| 75 74 td 1H J 18 73 \| 59 58 s 1H \| 35 34 m 4H \| 20 19 m 2H \| 19 18 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(COc2nn(C)cc2C(C)O)ccc1OCc1nc(-c2ccccc2)oc1C	ir: 3 4 5 8 4 10 5 2 3 2 2 2 1 2 1 3 2 3 5 8 11 10 10 3 2 2 3 1 1 4 4 7 11 8 4 4 2 4 3 0 5 27 19 3 1 1 2 1 1 3 1 3 8 11 7 5 3 3 3 3 1 4 3 5 9 6 11 19 14 10 3 2 2 2 2 1 3 3 4 2 2 3 5 1 6 4 4 14 38 10 19 55 6 3 1 3 8 4 1 3 2 3 2 1 2 4 2 1 2 3 1 1 1 1 1 1 3 4 3 5 3 9 4 1 8 3 1 3 10 16 2 1 1 2 4 27 7 2 14 6 1 5 13 7 4 3 1 1 1 6 8 2 2 2 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 1 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 0 1 1 1 1 1 1 1 1 3 2 0 1 2 1 1 1 2 1 0 2 1 3 3 4 6 17 25 14 12 16 11 9 67 100 67 25 7 3 5 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 0 1 0 1 1 1 1 1 1 1 0 1 1 0 1 0 1 0 1 1 0 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 1 0 0 0 1; 1HNMR: 80 79 m 2H \| 75 74 m 3H \| 71 71 s 1H \| 70 69 ddt 1H J 9 17 87 \| 69 69 dt 1H J 8 17 \| 68 68 d 1H J 87 \| 53 53 t 2H J 10 \| 53 52 s 2H \| 52 51 m 1H \| 39 38 d 6H J 27 \| 34 34 d 1H J 51 \| 24 24 s 2H \| 16 16 d 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)Cc1cn(Cc2cnc3c(N4CCOCC4)nc(-c4cccc(O)c4)nc3c2)nn1	ir: 8 5 6 6 9 9 8 7 7 6 9 8 6 6 6 10 9 6 5 4 6 7 18 5 5 5 8 5 15 12 12 9 37 32 49 11 6 19 7 12 7 4 6 8 6 6 7 25 11 5 5 4 8 10 4 6 10 11 10 8 7 20 7 26 19 17 17 7 12 64 7 7 6 7 6 5 6 6 38 36 16 15 19 30 10 11 72 19 4 6 6 9 18 30 15 13 7 12 10 7 10 7 4 7 5 4 5 14 4 4 4 6 6 7 11 6 13 17 5 9 12 6 9 6 5 15 8 8 15 100 47 17 11 4 7 6 13 13 3 5 7 13 5 5 19 29 7 5 4 3 5 14 71 36 9 11 4 24 4 5 4 0 5 9 9 6 4 3 4 4 4 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 3 3 4 4 4 3 4 4 3 4 4 4 3 3 4 4 4 4 4 4 4 3 4 4 3 4 4 4 3 4 4 4 3 3 4 4 3 4 4 4 3 4 4 4 3 4 4 4 4 4 4 3 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 4 3 4 4 4 4 4 4 4 4 4 4 3 4 4 4 4 4 5 4 4 7 5 4 4 4 6 5 7 9 7 26 34 37 14 15 18 8 5 5 86 16 10 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 3 4 4 4 4 4 4 4 3 4 4 4 3 4 4 4 4 4 4 4 3 4 4 4 3 4 4 3 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 4 4 4 3 4 4 4 3 4 4 4 3 4 4 4 3 4 4 4 3 4 4; 1HNMR: 85 84 dt 1H J 9 17 \| 78 77 m 2H \| 76 76 t 1H J 22 \| 74 74 p 1H J 9 \| 74 73 dd 1H J 83 93 \| 70 70 s 1H \| 69 68 ddd 1H J 13 22 84 \| 56 56 q 2H J 9 \| 39 39 d 2H J 7 \| 39 36 m 9H \| 27 26 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)CC1CCc2cc(OCCc3cccc(NC(=O)OC(C)(C)C)n3)ccc2C1	ir: 2 4 5 5 8 5 3 3 5 3 3 3 2 3 3 1 1 1 1 1 1 2 5 5 2 2 2 2 3 5 3 2 4 3 7 2 18 9 3 3 3 1 2 5 4 4 14 63 10 6 7 4 2 3 5 7 15 1 2 4 3 3 3 2 9 5 4 15 3 3 5 3 2 2 5 2 1 1 1 4 7 5 6 2 1 1 10 3 2 1 4 7 6 9 4 5 3 3 2 8 13 2 2 1 1 1 1 4 4 10 11 3 3 4 5 5 1 2 3 4 5 5 2 3 2 1 1 4 7 14 7 6 3 1 3 9 10 13 2 2 2 2 14 15 48 4 6 74 10 44 45 16 9 20 6 6 25 59 8 0 5 3 6 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 2 4 4 5 4 3 3 3 3 7 17 16 9 6 66 22 4 6 3 1 1 1 1 1 1 1 2 1 1 2 1 1 0 1 1 2 3 10 13 100 9 5 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 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 0 1 1 1 0; 1HNMR: 82 81 s 1H \| 77 77 dd 1H J 11 79 \| 76 75 t 1H J 77 \| 69 69 dt 1H J 9 90 \| 68 67 dq 1H J 9 73 \| 67 67 dd 1H J 21 91 \| 66 65 dt 1H J 8 19 \| 44 44 t 2H J 58 \| 42 41 q 2H J 66 \| 32 31 td 2H J 9 59 \| 30 26 m 4H \| 26 25 dd 1H J 76 164 \| 24 23 dd 1H J 77 165 \| 23 22 m 1H \| 20 19 dddd 1H J 59 66 84 134 \| 17 16 dddd 1H J 59 66 84 134 \| 15 14 s 7H \| 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.
Cc1cc(C(=O)O)ccc1C1=CCC2CC1C2(C)C	ir: 0 0 0 1 1 2 1 1 1 0 0 1 1 1 2 2 2 3 1 1 4 10 16 12 2 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 2 1 2 9 5 2 1 1 1 0 0 0 1 1 1 1 1 1 0 1 1 1 1 1 1 7 15 3 3 12 10 1 1 1 1 1 1 2 1 1 0 0 1 4 4 1 0 0 0 0 0 1 1 1 1 0 0 0 1 1 1 1 2 2 2 6 4 2 2 2 1 1 2 5 1 0 0 1 0 0 0 0 0 1 1 1 1 1 0 0 0 3 2 4 5 6 1 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 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 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 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 1 1 0 0 0 1 1 0 1 0 1 2 2 4 6 4 8 17 8 3 1 1 1 1 1 3 17 100 7 2 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 m 2H \| 73 72 d 1H J 80 \| 60 60 tt 1H J 18 45 \| 29 28 ddddd 1H J 12 22 34 42 80 \| 24 24 s 2H \| 23 23 dddd 1H J 9 46 57 150 \| 21 20 m 2H \| 19 18 tddt 1H J 16 47 64 79 \| 17 16 dt 1H J 63 111 \| 11 10 dt 6H J 15 203	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ir: 13 5 6 8 5 5 3 6 12 9 23 12 8 8 7 8 12 8 2 5 5 2 5 4 3 4 3 14 9 49 38 10 16 18 21 8 4 11 5 4 2 2 1 4 2 1 1 5 3 0 1 2 2 6 3 3 2 0 2 2 2 4 7 4 2 2 2 2 1 1 2 3 2 7 3 4 3 3 3 3 1 3 3 2 1 2 3 2 1 1 5 8 3 18 11 4 19 13 10 9 3 3 3 4 4 5 13 8 10 12 10 14 15 12 8 9 11 12 14 10 11 12 9 3 9 3 7 4 6 6 12 15 6 4 11 5 1 7 6 3 4 4 4 9 100 95 7 3 4 93 7 4 3 2 2 1 2 3 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 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 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 0 1 1 1 1 1 1 1 0 2 2 1 0 1 2 1 1 2 1 1 1 2 1 2 1 2 3 2 6 6 3 2 4 3 6 4 2 8 4 4 6 10 45 11 6 2 6 9 9 33 95 84 19 17 6 3 2 5 2 0 2 2 2 2 2 2 1 4 10 20 72 10 4 3 1 0 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 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; 1HNMR: 53 53 d 1H J 81 \| 52 51 d 1H J 79 \| 40 39 qd 1H J 49 73 \| 37 36 dq 1H J 70 80 \| 36 35 qt 1H J 67 80 \| 34 33 d 1H J 49 \| 19 18 ddd 1H J 75 82 150 \| 17 16 m 2H \| 16 16 m 1H \| 16 15 m 2H \| 16 13 m 18H \| 14 14 s 18H \| 12 11 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1Cc2cccnc2N1c1ccc(Oc2cn3ccccc3n2)cc1	ir: 1 2 12 6 1 2 3 2 2 2 3 2 5 2 3 3 2 2 2 2 2 2 3 2 2 7 8 3 2 2 2 2 3 17 53 11 1 5 3 0 7 3 3 2 10 38 14 6 5 3 2 0 3 15 32 26 10 2 5 10 11 7 8 12 11 16 14 16 3 12 2 1 2 2 2 1 2 2 1 3 4 3 5 3 5 8 7 8 4 4 4 2 2 2 2 2 10 3 1 3 3 2 5 6 17 4 3 7 3 2 1 2 3 3 1 2 2 2 1 2 3 2 3 5 13 7 4 4 6 2 2 3 11 4 3 4 6 11 2 5 5 5 2 3 2 3 11 14 12 50 42 21 29 16 24 20 23 8 4 3 2 2 2 3 2 1 3 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 4 3 2 2 2 2 3 4 4 7 9 24 36 60 66 100 14 6 4 5 2 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 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 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2; 1HNMR: 86 86 m 1H \| 84 84 dd 1H J 20 48 \| 78 77 m 2H \| 76 76 m 1H \| 76 76 s 1H \| 73 72 m 5H \| 69 68 ddd 1H J 16 68 82 \| 34 34 d 2H J 10	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(Br)cc1C1(C#N)CCC(=O)CC1	ir: 2 1 1 1 1 2 4 1 2 1 1 4 2 1 1 1 3 2 5 1 1 1 1 1 1 1 2 10 4 2 1 2 1 3 2 1 1 2 3 2 6 2 1 1 1 1 1 7 1 0 1 2 1 11 24 8 1 2 8 5 3 2 2 13 2 2 6 9 1 1 1 1 7 2 1 1 1 1 1 1 1 1 1 3 1 1 2 2 1 1 1 1 2 2 2 1 1 4 1 1 2 2 2 2 2 1 2 1 1 1 2 1 2 2 1 1 1 2 2 6 12 3 12 8 8 3 1 3 1 1 2 1 3 2 2 1 1 1 1 1 1 2 3 13 9 6 1 2 2 15 7 1 1 2 6 5 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 17 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 8 9 2 2 2 2 2 2 2 19 7 10 100 15 4 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 75 d 1H J 21 \| 74 74 dd 1H J 22 82 \| 68 68 d 1H J 81 \| 38 38 s 2H \| 27 26 ddd 2H J 39 63 143 \| 26 25 m 5H \| 24 23 ddd 2H J 38 62 130	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1[C@@H](CCSc2ccc(F)cc2)COC1(C)C	ir: 3 2 24 22 6 3 7 4 3 5 5 5 5 2 1 2 4 10 7 3 6 11 7 2 1 0 1 1 1 1 1 3 1 1 1 1 1 0 1 1 4 3 2 1 1 1 1 0 1 1 1 4 12 16 17 21 12 3 7 7 4 2 3 2 1 0 1 2 2 3 2 1 1 0 2 1 0 0 1 1 1 1 1 1 2 4 4 2 1 1 2 1 1 3 8 3 6 4 5 4 4 6 12 6 9 2 4 5 3 2 4 2 0 3 3 4 3 6 18 10 8 6 11 7 3 4 8 5 2 20 22 100 17 2 1 2 2 1 0 1 1 1 1 3 4 15 10 3 4 7 12 77 8 2 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 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 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 0 1 1 1 1 1 1 1 1 1 2 3 2 1 3 5 3 1 2 3 4 4 5 15 26 10 21 19 26 25 10 6 5 3 1 1 1 1 0 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 73 73 m 2H \| 71 70 m 2H \| 40 39 m 2H \| 38 37 dd 1H J 53 103 \| 30 30 dt 1H J 59 137 \| 29 28 dt 1H J 59 137 \| 21 20 m 1H \| 19 18 m 1H \| 16 16 s 3H \| 15 14 d 11H J 123	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)N1CCCC(n2nc(-c3ccc(Oc4ccc(Cl)c(C)c4)cc3)c(C#N)c2N)C1	ir: 4 3 1 5 3 3 1 2 6 2 3 3 1 3 3 5 7 4 3 4 9 10 5 5 13 2 1 6 4 8 3 2 3 1 4 2 3 7 4 6 4 2 2 1 2 2 2 2 2 3 1 1 1 6 6 4 11 3 2 1 4 2 1 1 3 4 2 1 4 8 6 2 2 1 1 1 1 1 2 1 1 1 1 1 1 2 2 3 3 2 4 6 2 2 2 2 2 1 1 1 1 1 2 2 1 3 1 2 3 2 6 3 2 3 2 1 1 2 3 1 1 2 3 3 4 11 5 3 4 6 6 3 2 3 17 1 1 3 6 2 5 4 7 100 4 1 4 48 19 3 6 10 2 3 1 2 3 2 8 16 6 2 1 3 1 0 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 2 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 1 0 1 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 2 2 0 1 1 1 2 1 1 2 2 3 4 2 3 7 6 5 14 14 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 17 15 2 1 1 1 1 1 1 1 6 13 65 4 2 1 1 1 1 1 0 0 1 0 0 0 0 0 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 0 1 0 0 1 1 0 0 1 1 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 0; 1HNMR: 77 77 m 2H \| 73 72 d 1H J 87 \| 71 70 m 2H \| 69 68 dd 1H J 21 87 \| 68 67 m 1H \| 47 46 tt 1H J 28 43 \| 41 40 dd 1H J 28 122 \| 38 37 dd 1H J 29 123 \| 35 34 ddd 1H J 32 56 120 \| 34 33 ddd 1H J 31 58 121 \| 33 32 s 2H \| 23 23 s 3H \| 21 21 s 3H \| 21 20 m 1H \| 20 19 m 1H \| 19 18 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)CCC(=O)c1ccc2c(c1)Cc1cccc(C(=O)O)c1-2	ir: 0 0 0 1 0 0 0 0 0 0 1 0 0 1 1 1 1 3 5 3 5 10 5 3 2 1 1 0 0 0 0 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 2 4 4 7 1 1 1 1 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 1 2 2 1 0 0 1 0 1 1 0 0 0 0 0 1 1 1 0 0 0 0 1 0 0 2 4 6 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 2 7 2 1 0 0 1 0 2 36 100 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; 1HNMR: 80 80 d 1H J 85 \| 80 80 dt 1H J 8 20 \| 79 79 ddd 2H J 16 70 86 \| 77 76 dq 1H J 10 79 \| 73 73 m 1H \| 40 39 t 2H J 9 \| 34 33 t 2H J 90 \| 28 27 t 2H J 91	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCCCCCCCCCCCCCCOCC(CO)(OC)OC	ir: 2 2 3 2 4 2 3 1 2 3 1 6 2 3 4 3 4 2 5 6 2 2 3 1 2 1 1 2 1 0 1 1 1 1 3 14 4 3 1 4 4 1 2 2 2 1 1 1 1 2 2 2 1 1 2 2 1 1 2 1 1 2 3 3 8 3 3 3 8 7 8 5 3 1 2 3 1 2 2 2 3 4 4 4 7 12 32 61 9 9 5 5 3 7 5 3 2 2 3 3 1 1 2 2 2 2 4 6 4 3 5 4 4 3 4 2 1 11 3 12 9 4 4 2 2 1 2 2 1 1 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 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 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 1 1 1 0 1 1 1 1 1 2 2 1 1 3 2 2 2 2 2 6 4 6 5 3 3 2 2 3 3 16 15 10 4 3 2 1 2 3 2 3 11 100 82 17 3 2 1 1 1 1 1 1 2 3 1 1 1 1 1 0 1 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 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 0 1 0 0; 1HNMR: 38 38 dd 1H J 48 70 \| 38 37 d 4H J 71 \| 35 35 t 2H J 53 \| 34 33 s 5H \| 16 15 tt 2H J 53 75 \| 13 12 m 30H \| 9 9 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1c(C(=Nc2ccccc2)c2ccccc2)n(O)c2ccccc12	ir: 29 18 42 10 8 8 8 10 2 4 30 18 6 9 7 3 6 3 2 3 2 3 2 3 2 2 3 4 5 10 27 21 15 22 5 4 6 10 7 2 21 32 36 22 9 4 8 7 7 4 6 1 2 3 2 1 3 4 2 1 1 1 2 4 7 3 3 20 16 29 5 4 14 9 5 4 6 10 11 9 5 3 82 68 17 4 1 2 6 9 17 72 43 13 6 5 4 4 3 2 2 1 1 1 2 6 8 2 1 5 17 13 2 2 2 1 2 4 3 2 1 2 5 6 3 2 2 1 1 3 4 2 3 15 17 54 20 18 8 3 29 18 14 48 31 19 6 8 4 6 35 21 4 1 3 7 6 0 1 9 6 3 2 2 1 1 1 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 4 5 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 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 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 2 3 2 0 3 13 7 25 41 81 100 45 9 4 5 6 21 87 25 5 2 1 2 2 1 0 2 2 1 1 1 2 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 81 80 dd 1H J 14 68 \| 76 76 dd 1H J 15 74 \| 76 75 m 2H \| 75 75 td 1H J 13 73 \| 75 74 m 3H \| 74 73 m 2H \| 73 73 m 1H \| 72 71 m 2H \| 71 70 tt 1H J 14 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=c1c2cnc(Nc3ccc(N4CCNCC4)cc3)nc2ccn1-c1c(Cl)cccc1Cl	ir: 11 9 12 9 9 8 9 9 9 9 9 9 9 10 10 9 9 10 9 10 9 9 12 11 12 33 16 10 13 9 8 9 9 12 10 24 10 9 10 13 11 11 10 13 50 54 21 27 12 11 9 8 10 19 19 72 19 31 13 11 16 9 9 10 9 9 8 9 12 9 10 9 9 9 8 9 9 17 12 9 9 9 9 9 9 14 10 11 9 11 9 10 9 11 12 9 11 16 11 10 11 11 9 17 14 12 9 9 11 45 19 11 8 11 13 14 15 9 9 8 10 9 9 9 8 9 18 11 10 23 12 9 9 9 9 9 25 12 13 11 16 9 9 9 9 7 18 18 9 9 10 9 16 25 100 68 17 22 9 12 9 0 19 5 16 10 9 8 8 9 8 8 8 9 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 9 9 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 9 8 8 8 9 9 9 10 9 8 9 9 9 8 9 11 11 13 14 36 21 18 14 9 10 10 9 8 9 9 8 8 9 9 9 10 11 11 33 32 14 11 13 33 45 43 33 8 9 9 8 8 10 9 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8; 1HNMR: 92 91 s 1H \| 91 91 s 1H \| 83 82 d 1H J 77 \| 75 75 m 2H \| 74 74 m 2H \| 73 72 m 1H \| 69 68 m 3H \| 33 33 m 4H \| 30 29 m 4H \| 20 19 p 1H J 33	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2N2CCC(=O)CC2)cc1	ir: 18 7 4 3 5 5 5 10 7 3 8 6 17 10 10 1 4 4 4 13 2 2 3 2 1 1 2 3 6 7 7 5 2 13 14 9 4 2 4 3 12 23 14 6 4 4 4 11 12 11 11 13 20 39 19 35 25 16 3 8 8 9 5 1 10 19 8 3 5 3 23 5 5 5 4 2 3 3 2 1 2 4 46 11 28 44 5 3 8 6 4 5 9 12 8 21 7 8 12 6 4 3 2 7 21 21 19 2 4 3 2 3 8 13 9 14 4 8 8 9 16 7 11 8 24 9 6 6 4 2 2 3 2 1 1 2 2 4 31 4 4 4 18 5 19 34 55 29 12 47 10 6 2 37 5 10 2 2 2 1 2 7 39 7 2 0 1 3 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 1 2 1 1 2 2 1 1 1 1 1 1 2 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 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 3 1 3 4 3 1 3 3 2 2 2 5 5 0 34 9 28 51 21 11 6 4 3 2 2 2 2 2 1 1 1 2 1 1 2 3 2 3 7 9 39 34 7 9 20 100 11 4 3 3 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2; 1HNMR: 93 92 s 1H \| 91 90 s 1H \| 78 78 m 2H \| 77 76 m 2H \| 74 74 dd 1H J 14 82 \| 72 72 td 1H J 14 80 \| 70 69 td 1H J 15 78 \| 69 68 dd 1H J 15 75 \| 36 36 m 4H \| 28 28 m 4H \| 22 21 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(O)c1cnc(Cl)c(Cl)c1	ir: 10 8 5 11 10 7 8 24 10 7 8 9 6 6 6 6 6 5 5 6 6 5 5 6 6 5 5 5 6 5 5 8 7 11 15 16 46 9 5 10 6 4 6 6 5 4 5 5 5 5 6 6 8 6 6 9 7 5 6 6 5 5 5 5 7 10 12 15 33 10 8 8 12 7 6 7 8 8 9 8 7 23 10 9 15 23 20 48 48 36 46 11 9 9 17 9 7 5 7 6 6 9 7 6 5 6 7 6 7 9 7 6 4 6 10 8 17 13 16 21 10 7 11 10 48 46 15 8 9 8 8 6 5 6 6 4 4 6 7 2 1 100 0 7 6 4 4 5 5 4 5 5 5 25 11 5 5 5 5 8 6 5 5 5 5 5 5 5 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 5 5 5 5 4 5 5 5 4 5 5 4 5 5 5 5 5 5 5 5 4 5 5 4 5 5 5 4 5 5 5 4 5 5 5 5 5 5 5 4 5 5 5 5 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 5 5 5 4 4 5 5 5 4 5 5 5 4 5 5 5 5 6 6 7 7 6 7 7 6 8 6 7 6 7 8 6 9 7 15 11 21 37 11 7 10 9 10 7 38 96 16 9 7 9 6 6 6 6 6 6 6 8 5 6 5 6 6 6 6 5 6 6 6 6 6 5 6 5 5 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4 5 5 5 4; 1HNMR: 83 83 d 1H J 17 \| 76 75 m 1H \| 51 51 m 1H \| 36 36 d 1H J 55 \| 15 15 d 3H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccccc1-n1nc(-c2c(-c3ccc(F)cc3)nn3c2NCC2(CCSCC2)C3)ccc1=O	ir: 1 1 3 3 2 5 1 3 3 6 12 14 38 7 13 21 6 19 14 3 8 3 5 0 1 1 2 1 7 7 5 8 4 22 4 2 5 3 3 1 6 13 56 8 23 5 4 3 2 2 5 2 2 12 24 26 47 34 27 12 4 3 2 2 1 3 1 2 9 7 12 2 3 4 1 2 1 2 1 1 2 3 1 5 3 2 7 1 1 1 7 3 4 4 24 9 4 3 4 5 3 2 1 1 3 5 2 8 13 5 3 1 10 10 3 2 4 11 38 4 3 11 3 5 1 4 4 3 3 3 5 15 4 7 7 19 34 54 3 14 21 25 12 1 9 2 2 2 9 100 6 22 28 20 26 4 2 3 3 29 6 1 2 5 21 2 1 1 1 1 0 1 0 1 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 2 1 4 6 2 4 2 3 3 1 3 9 15 6 33 36 19 38 6 7 14 8 6 3 2 3 2 2 1 2 1 1 2 3 2 2 5 12 38 33 14 19 8 5 22 4 0 1 2 3 1 1 1 1 0 0 1 1 0 1 1 1 0 0 1 0 0 1 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 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 78 77 d 1H J 90 \| 77 76 m 3H \| 76 75 dd 1H J 15 67 \| 74 74 ddd 1H J 14 68 80 \| 74 73 td 1H J 16 78 \| 72 71 m 2H \| 70 70 d 1H J 90 \| 64 64 t 1H J 45 \| 40 40 s 2H \| 36 36 d 2H J 44 \| 28 28 ddd 2H J 27 54 136 \| 27 26 ddd 2H J 26 53 134 \| 24 23 s 2H \| 19 18 ddd 2H J 27 55 130 \| 17 16 ddd 2H J 27 55 130	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCN(C)C(=O)c1cc(C(=O)OCC)cc(C(O)C2CC2)c1	ir: 16 11 9 8 8 4 8 4 3 16 6 3 3 3 4 5 2 3 1 3 4 4 2 2 5 5 2 2 2 3 3 3 7 13 5 6 6 11 10 26 12 25 8 6 3 2 1 2 2 1 4 2 1 1 1 2 4 2 2 4 2 2 6 6 11 11 18 11 21 19 6 5 5 8 5 4 3 2 1 2 2 4 6 4 23 19 46 32 74 13 31 6 4 3 7 5 9 3 6 2 1 2 3 1 1 2 4 2 2 10 4 8 9 23 10 6 14 11 16 8 33 9 2 12 11 5 13 19 19 24 10 8 7 2 4 8 12 7 3 1 2 3 4 2 14 16 38 14 29 25 8 6 5 6 2 1 1 1 1 1 1 1 1 4 1 1 1 0 1 1 0 0 1 1 1 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 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 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 1 1 2 1 2 2 2 3 4 2 3 2 2 2 6 2 10 6 14 10 13 51 22 4 9 18 10 4 22 100 6 4 3 2 2 1 2 1 1 1 2 2 1 1 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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; 1HNMR: 83 82 t 1H J 22 \| 80 80 dt 1H J 13 26 \| 79 78 td 1H J 7 22 \| 48 47 m 1H \| 44 44 q 2H J 64 \| 34 33 d 1H J 37 \| 33 33 t 2H J 69 \| 30 30 s 2H \| 19 18 dp 1H J 60 72 \| 17 16 m 2H \| 14 14 m 5H \| 12 11 m 2H \| 10 9 t 3H J 76	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc2cc(N)c(N)nc12	ir: 6 7 13 11 6 4 1 6 2 9 11 8 10 7 6 4 5 11 8 12 8 7 8 4 5 4 3 5 4 2 3 4 3 2 6 4 3 2 3 2 3 2 2 3 12 17 12 2 2 6 6 11 6 4 2 1 2 2 2 1 2 3 1 2 4 4 2 1 2 2 3 2 2 2 1 1 4 3 4 1 2 3 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 6 5 1 1 1 1 1 1 3 2 3 3 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 4 1 4 2 1 1 2 1 2 3 2 2 2 2 1 3 7 32 53 16 5 16 10 22 19 3 1 2 12 20 12 2 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 1 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 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 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 2 1 1 2 2 5 3 8 4 2 1 1 1 1 1 1 1 1 1 1 1 2 1 2 8 36 11 2 1 2 1 1 1 2 4 12 100 34 37 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 0 1 1 0 0 1 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: 76 75 dt 1H J 20 77 \| 74 74 d 1H J 22 \| 74 73 m 2H \| 52 52 s 2H \| 47 47 s 2H \| 27 26 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1nc(Nc2ccc(-n3cnc(C)c3)c(OC)c2)nc(Oc2cc(F)c(F)c(F)c2)n1	ir: 2 1 1 1 1 2 2 3 2 2 3 2 3 2 1 1 0 1 2 3 1 2 1 1 2 2 2 4 1 1 1 1 1 3 7 6 7 5 9 4 4 1 1 3 3 1 1 1 1 3 13 5 3 2 3 19 4 5 2 2 1 1 1 1 5 11 44 50 27 8 2 5 1 10 4 1 2 1 2 3 1 1 1 1 1 1 0 1 1 2 1 1 1 3 5 8 2 1 2 2 6 1 1 1 1 1 1 10 30 100 5 3 1 3 1 1 2 3 7 3 3 4 3 4 8 11 10 9 2 8 2 1 1 1 1 1 2 1 0 1 1 1 1 7 2 1 2 1 1 1 8 12 1 2 3 11 2 1 1 1 7 6 4 49 1 2 61 5 1 0 0 1 0 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 2 5 0 1 1 1 0 1 2 2 1 3 4 9 11 27 16 18 74 63 41 8 4 1 1 1 1 1 1 2 0 1 1 1 1 1 1 1 1 2 3 8 4 2 3 4 2 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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; 1HNMR: 92 92 s 1H \| 79 79 d 1H J 16 \| 77 76 d 1H J 79 \| 75 74 m 1H \| 73 72 dd 1H J 21 80 \| 71 71 m 2H \| 68 68 d 1H J 21 \| 40 39 s 3H \| 39 39 s 3H \| 23 23 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCN(CCCCN1C(=O)CC(C)(C)CC1=O)C1COc2cccc(OC)c2C1	ir: 3 2 4 2 2 1 2 3 0 3 4 2 3 2 2 2 1 1 5 2 4 3 1 2 1 1 2 1 1 1 1 1 2 1 2 4 3 3 1 1 1 1 2 1 2 5 12 9 4 3 3 1 2 3 8 4 10 5 4 7 8 3 3 5 2 3 4 2 2 1 1 1 1 3 4 4 4 2 2 1 1 1 2 3 3 3 5 3 6 3 8 7 3 2 3 1 1 2 2 2 1 1 2 2 2 1 2 1 1 3 2 3 2 1 1 2 3 3 3 4 4 4 3 8 3 4 1 3 3 2 2 5 2 2 2 1 1 2 4 4 3 5 3 1 1 2 10 43 15 3 3 8 15 100 8 4 2 10 2 2 1 0 0 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 0 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 4 3 3 3 2 2 3 2 5 4 6 7 3 16 6 2 1 1 1 1 1 1 1 1 1 1 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 71 70 t 1H J 81 \| 66 66 dq 2H J 9 80 \| 44 43 dd 1H J 46 104 \| 41 40 dd 1H J 47 105 \| 39 38 m 4H \| 32 30 m 2H \| 28 25 m 6H \| 25 25 s 4H \| 17 16 m 2H \| 16 14 m 5H \| 11 11 s 5H \| 10 9 t 3H J 77	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2c(c1)[nH]c1ccc(O)cc12	ir: 6 7 18 6 5 3 2 3 3 7 6 7 1 4 8 4 9 4 2 7 4 4 5 4 2 3 6 2 2 2 3 2 3 2 3 3 1 2 2 1 2 2 2 1 1 2 2 1 2 2 2 3 13 51 46 17 7 4 4 2 2 3 3 2 3 15 20 14 11 13 6 6 10 9 4 2 4 6 19 82 49 27 11 4 2 2 2 3 7 17 14 8 2 1 2 8 2 1 2 1 1 1 1 1 1 1 2 2 19 6 4 46 10 2 1 1 1 2 3 2 2 2 3 10 4 4 7 2 1 1 1 1 1 1 1 1 1 1 6 3 3 8 1 4 3 2 1 1 2 3 5 6 15 14 12 5 5 1 1 1 1 2 2 36 5 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 1 1 1 1 1 1 1 2 2 2 1 2 2 1 1 2 2 1 2 2 1 1 2 3 2 3 7 15 71 38 100 6 4 3 3 0 7 26 52 3 1 1 1 1 1 1 1 1 1 2 3 3 4 3 4 6 9 3 2 3 3 2 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 94 94 s 1H \| 86 85 s 1H \| 79 79 d 1H J 85 \| 75 75 d 1H J 24 \| 73 73 d 1H J 77 \| 70 70 d 1H J 24 \| 68 68 dd 1H J 22 77 \| 68 68 dd 1H J 23 83 \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NCc1ccccc1)c1cccc(-c2nc(=O)c3ccccc3s2)n1	ir: 4 4 2 4 4 4 4 4 4 3 4 3 4 3 3 3 4 3 3 4 3 3 3 3 3 3 3 6 18 9 24 5 4 8 10 2 4 6 8 13 100 9 2 8 5 0 3 6 5 12 4 5 4 2 3 5 3 1 3 5 3 1 3 5 3 2 3 4 6 6 4 6 3 2 4 4 3 3 5 6 7 2 4 5 3 4 5 3 3 5 4 3 2 3 3 3 3 5 9 4 2 3 4 3 2 3 6 4 2 3 4 3 2 3 5 6 4 4 5 6 6 7 5 3 3 3 3 3 5 11 6 3 3 6 9 10 4 10 4 5 6 4 10 7 4 15 8 12 3 4 4 12 13 4 5 3 4 6 4 3 3 3 3 2 3 3 3 2 3 4 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 3 3 3 2 3 4 3 2 3 4 3 3 3 4 5 7 14 27 26 9 5 4 3 3 4 3 3 2 3 3 3 3 4 4 3 3 3 3 3 3 5 7 47 5 4 3 3 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 3 2; 1HNMR: 84 84 dd 1H J 13 66 \| 84 83 t 1H J 61 \| 81 80 dd 1H J 12 79 \| 80 79 m 2H \| 79 79 dd 1H J 18 71 \| 77 76 td 1H J 16 72 \| 76 75 td 1H J 18 71 \| 74 72 m 3H \| 73 73 s 3H \| 46 46 dt 2H J 8 61	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc2ccccc2cc1C(=O)Nc1nnn[nH]1	ir: 1 1 1 1 1 1 1 1 1 1 1 6 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 5 5 1 1 1 1 3 6 4 3 2 4 10 24 11 5 2 3 2 1 2 1 2 1 1 6 13 2 3 1 0 1 1 2 8 2 1 1 0 1 1 1 1 2 1 0 0 5 1 0 0 1 1 0 1 1 1 1 1 1 1 0 8 2 4 2 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 0 1 1 2 0 1 2 12 3 13 2 2 1 1 1 1 4 1 1 4 11 10 1 2 4 10 2 5 2 100 6 6 4 0 1 1 1 0 1 1 1 5 1 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 3 4 19 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 6 8 3 7 19 17 13 4 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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: 84 84 d 1H J 20 \| 79 79 m 1H \| 77 77 m 1H \| 76 76 ddd 1H J 15 68 82 \| 75 75 d 1H J 24 \| 75 74 ddd 1H J 15 70 81 \| 39 39 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCC[C@@H]1CC[C@@H](c2ccc(C#CC#N)cc2)CC1	ir: 5 3 2 4 5 3 2 3 4 3 3 6 29 17 4 3 4 3 3 4 4 3 3 4 6 3 10 9 4 5 5 4 4 3 3 5 4 3 4 8 8 4 4 5 4 2 3 5 5 5 5 9 31 53 46 6 10 3 17 5 8 4 4 4 4 3 4 4 3 4 15 4 4 3 4 4 3 3 3 4 3 3 4 4 3 3 4 4 10 3 4 4 3 4 6 5 10 12 4 4 3 4 6 4 12 22 8 5 7 6 11 7 9 7 9 6 5 11 12 11 12 7 9 6 9 13 9 6 7 9 4 4 6 4 5 5 2 4 4 3 3 4 4 3 3 8 11 56 17 5 3 5 18 5 4 5 4 3 3 3 7 3 3 3 3 3 3 4 3 2 3 5 2 21 4 0 3 5 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 5 4 3 3 3 3 3 3 3 4 3 3 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4 3 3 4 4 3 3 4 3 3 3 4 4 3 3 5 4 4 4 4 5 8 10 14 9 4 6 6 6 10 9 11 36 36 39 100 20 16 10 7 8 5 5 4 4 3 4 4 4 5 4 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 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 3 3 3 3 3 4 3 3; 1HNMR: 74 74 m 2H \| 72 72 m 2H \| 26 25 tt 1H J 44 70 \| 18 17 m 2H \| 16 11 m 15H \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(-c2ccc3c(C(N)=O)c(C(=O)c4ccc(Cl)cc4Cl)oc3c2)c1	ir: 2 2 2 4 5 3 4 2 4 5 12 12 14 6 3 4 6 7 9 4 3 4 3 7 15 5 4 2 2 5 6 6 8 6 11 4 3 3 9 7 5 3 4 2 2 3 8 12 3 3 2 2 3 8 16 13 7 2 2 2 1 2 2 2 2 4 8 13 5 9 2 2 4 3 4 2 4 3 2 1 3 3 3 4 3 2 2 2 2 2 6 3 2 3 3 2 3 10 2 3 2 1 1 1 2 5 1 1 2 1 4 2 2 2 2 3 3 5 4 4 5 4 5 7 9 2 2 2 2 2 3 2 1 1 1 2 3 6 2 3 20 3 2 3 2 7 4 14 3 14 6 26 17 3 6 6 10 100 4 4 10 2 1 3 3 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 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 1 1 2 3 2 1 2 4 2 0 4 8 10 31 27 3 3 4 3 2 2 2 1 1 1 2 1 1 1 1 3 22 2 2 2 1 2 2 2 2 2 2 3 2 48 9 3 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 2 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 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 79 d 1H J 81 \| 77 77 d 1H J 22 \| 76 76 m 3H \| 76 75 s 2H \| 75 75 dd 1H J 21 87 \| 75 74 ddd 1H J 14 22 76 \| 74 74 m 2H \| 72 72 m 1H \| 20 19 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)NC(=O)c1c(OCc2ccccc2)c(=O)cc(CNS(=O)(=O)c2ccc(Cl)cc2)n1C	ir: 6 4 6 11 10 4 2 2 1 2 4 34 11 3 3 3 3 8 12 4 4 1 2 2 1 1 1 2 3 4 20 10 20 8 5 3 8 7 6 11 59 9 40 96 14 5 5 7 13 17 10 19 10 8 16 10 4 3 3 3 6 5 6 3 9 53 100 64 35 2 13 10 6 1 5 3 2 3 3 14 6 2 20 38 9 7 8 80 23 15 3 8 31 7 2 26 5 8 11 5 6 3 5 28 30 26 29 9 28 12 2 2 4 2 4 4 3 2 11 6 6 6 5 8 6 3 6 2 4 2 2 2 3 3 6 21 4 2 2 3 3 16 5 10 47 61 7 5 10 8 68 7 3 5 5 15 4 2 1 0 1 2 5 55 1 0 0 0 0 0 0 0 0 1 1 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 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 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 1 1 2 1 1 0 2 2 1 1 1 3 1 1 3 6 9 4 40 42 26 27 5 2 3 2 1 2 1 0 1 0 1 1 1 2 1 2 3 8 91 19 6 8 16 27 17 17 5 4 5 2 1 1 1 0 1 0 1 0 1 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: 82 81 d 1H J 84 \| 78 77 m 2H \| 76 76 m 2H \| 74 73 m 5H \| 64 64 t 1H J 13 \| 60 59 t 1H J 66 \| 52 52 d 1H J 9 \| 42 41 dd 2H J 13 66 \| 41 40 dp 1H J 58 84 \| 36 35 s 2H \| 12 12 d 6H J 59	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CCOC(=O)N1C(C)CC[C@@H]1C(=O)NC(C)C	ir: 9 6 5 7 6 4 5 6 5 5 7 7 6 6 9 11 5 7 6 4 4 5 5 5 5 7 7 7 15 8 17 10 7 7 12 7 10 18 56 17 16 8 12 14 8 6 6 4 5 6 5 4 5 3 4 7 5 14 5 4 6 7 5 6 5 5 9 9 13 10 14 10 9 6 7 5 5 4 5 4 4 4 4 5 8 5 4 4 4 4 5 6 6 6 6 4 6 5 4 4 3 4 5 9 8 6 6 8 11 9 6 7 6 7 11 6 5 7 12 14 11 9 8 8 6 6 9 6 7 12 12 39 14 6 6 5 8 9 7 4 4 6 8 3 3 30 51 100 48 18 38 65 10 0 2 8 5 1 3 6 4 2 3 5 4 2 3 5 4 2 3 5 4 2 4 5 3 2 4 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 3 4 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 3 4 4 3 3 4 4 3 3 4 4 4 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 3 3 4 4 4 4 6 4 4 5 4 4 5 5 7 6 6 14 10 7 14 25 14 14 5 7 5 6 7 4 6 6 5 4 4 4 4 4 5 4 4 5 5 5 6 6 14 9 17 16 16 13 12 9 10 8 4 5 4 3 3 4 4 3 3 4 4 3 3 4 3 3 3 4 4 3 4 5 4 3 3 4 3 3 3 4 3 3 3 4 3 3 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 3 3 4 3 3 3 4 3 3 3 4 3 3 3 4; 1HNMR: 68 67 d 1H J 82 \| 60 59 m 1H \| 53 53 ddt 1H J 13 25 170 \| 53 52 m 1H \| 47 46 dt 2H J 14 60 \| 43 43 m 1H \| 40 38 m 2H \| 22 21 m 1H \| 21 20 m 1H \| 19 18 m 2H \| 13 12 d 3H J 60 \| 11 10 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC1CCN(c2cncc(-c3c[nH]c4ccc(C(=O)O)cc34)n2)CC1	ir: 0 1 2 2 1 4 4 3 1 2 3 2 3 8 8 2 2 3 4 5 2 56 66 15 3 4 3 2 2 2 2 2 1 2 2 3 1 2 3 1 1 2 1 1 3 6 4 1 2 2 1 3 9 6 11 5 4 5 1 0 2 6 4 0 3 11 7 2 5 5 3 1 2 2 2 3 18 25 10 3 7 6 2 1 2 5 4 4 2 1 1 1 3 4 1 1 2 1 1 3 3 4 4 2 3 2 2 4 3 1 2 2 5 9 7 12 5 5 1 4 8 5 1 5 10 3 2 6 6 4 6 2 8 9 8 10 7 9 3 2 4 2 2 3 2 9 8 2 1 1 1 2 1 0 3 5 3 2 2 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 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 1 2 2 1 1 1 1 1 1 3 5 2 6 2 2 3 5 2 2 1 1 7 17 3 0 3 8 6 1 4 4 2 1 6 80 100 8 7 12 10 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 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: 88 87 dd 2H J 15 93 \| 86 85 d 1H J 75 \| 79 78 dd 1H J 15 74 \| 78 78 d 1H J 16 \| 76 76 d 1H J 75 \| 39 38 m 2H \| 37 36 ddd 2H J 60 88 145 \| 31 30 tp 1H J 38 56 \| 21 20 dddd 2H J 38 60 88 134 \| 18 17 dddd 2H J 38 60 88 134 \| 17 16 d 2H J 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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