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FC(F)(F)C1(c2cc(Cl)cc(Cl)c2)CC(c2ccc(Br)c(CBr)c2)=NO1	ir: 4 2 2 2 5 7 5 2 0 2 3 2 0 4 5 5 3 2 2 2 1 2 2 2 1 2 1 1 1 2 3 14 1 3 3 0 2 5 1 4 2 6 2 1 1 2 1 0 1 2 1 0 2 31 13 8 2 2 2 1 1 3 3 15 11 9 36 15 15 7 5 1 2 2 1 1 1 2 1 0 2 3 0 1 2 5 4 8 45 8 9 5 9 11 8 7 6 41 5 2 66 4 6 3 12 39 23 7 2 3 5 4 4 2 3 1 1 2 4 2 2 4 6 10 14 3 8 10 14 12 15 5 5 2 1 1 2 2 19 15 9 10 2 1 1 1 1 2 2 2 5 4 2 1 3 4 2 4 16 2 10 3 2 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 8 8 3 2 1 2 3 3 10 26 21 57 100 28 23 8 5 2 3 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; 1HNMR: 77 76 dd 1H J 20 84 \| 76 76 d 1H J 84 \| 74 73 m 4H \| 46 45 d 2H J 10 \| 35 34 dq 1H J 22 163 \| 32 31 dq 1H J 24 163	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCC(C(=O)O)c1c(C)nc(N2CCc3ccccc32)nc1-c1ccc(C)cc1	ir: 3 4 5 4 1 3 2 3 3 5 9 9 12 6 4 5 1 4 4 9 16 87 100 28 23 4 7 7 3 1 2 3 5 3 5 6 9 10 7 2 23 36 25 28 6 8 6 4 5 4 2 2 4 18 19 4 3 2 2 1 4 3 2 3 2 2 3 4 12 11 5 5 5 1 6 7 7 35 27 30 11 5 1 2 3 5 6 4 12 5 5 7 3 3 6 3 3 2 4 6 3 2 0 1 2 2 2 2 4 4 11 6 9 2 10 8 1 10 11 7 5 8 5 3 14 19 7 3 1 1 1 1 3 7 4 2 0 32 45 4 6 4 16 30 65 88 41 17 6 39 54 36 35 4 2 2 1 1 0 1 3 13 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 0 0 1 1 1 1 1 1 1 4 2 3 3 2 2 2 4 5 4 17 9 15 10 49 11 7 2 2 3 4 6 55 83 18 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 77 76 m 2H \| 73 73 m 2H \| 72 71 td 1H J 17 74 \| 71 71 ddt 1H J 9 18 82 \| 70 70 dd 1H J 14 73 \| 70 69 td 1H J 15 80 \| 42 41 t 2H J 60 \| 41 40 t 1H J 80 \| 31 30 m 2H \| 24 24 s 2H \| 24 23 d 3H J 8 \| 22 21 ddt 1H J 65 81 131 \| 19 18 ddt 1H J 65 79 132 \| 16 15 m 1H \| 15 14 ddtd 1H J 65 75 130 140 \| 10 9 t 3H J 74	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(C(=O)OC)c(OC)c1	ir: 18 31 17 19 8 13 26 9 13 18 18 13 5 7 8 7 9 13 17 7 6 6 14 20 22 12 7 2 1 5 5 2 2 5 5 2 4 9 5 1 3 6 4 1 2 6 4 1 3 6 8 4 10 43 35 13 8 8 5 3 11 10 2 1 5 9 15 11 24 38 14 3 5 8 8 12 9 5 3 2 4 5 3 3 17 21 4 3 6 5 4 6 7 5 1 2 5 5 1 4 7 9 6 3 6 4 1 3 7 4 2 41 57 19 11 15 12 14 19 13 27 5 5 5 3 24 30 11 25 8 1 5 6 2 1 4 5 4 6 7 9 50 61 49 26 52 67 100 11 3 2 8 7 2 8 9 7 0 2 7 4 0 3 16 11 1 3 6 3 0 3 6 3 0 3 6 3 0 3 5 2 0 4 5 2 0 4 5 2 1 4 5 2 1 4 5 2 1 5 5 1 1 4 4 1 2 5 4 1 2 5 4 1 2 5 3 1 2 5 3 0 2 5 3 0 3 5 3 0 3 5 3 0 3 5 3 0 3 5 2 1 3 5 2 1 4 5 2 1 4 4 2 1 4 4 2 2 4 4 1 2 4 4 2 2 4 4 1 3 5 4 2 3 5 3 2 3 4 4 2 5 8 8 11 11 8 39 67 93 35 8 3 6 7 3 0 4 6 2 1 4 5 2 1 4 5 2 1 4 5 2 1 4 4 1 2 4 4 1 2 4 4 1 2 5 4 1 2 5 3 1 2 5 3 1 2 5 3 0 3 5 3 0 3 5 3 1 3 5 2 1 3 5 2 1 3 5 2 1 3 4 2 1 4 4 2 1 4 4 2 2 4 4 2 2 4 4 1 2 4 3 1 2 4 3 1 2 5 3 1 2 5 3 1 3 5 3 1 3 5; 1HNMR: 79 79 d 1H J 85 \| 78 77 dd 1H J 20 86 \| 76 76 d 1H J 20 \| 39 39 d 9H J 47	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCN1N=C(c2ccc(Cl)cc2)CC1=O	ir: 4 4 2 3 4 4 2 3 3 4 8 5 16 18 2 3 4 3 6 3 3 2 8 6 5 11 4 4 4 2 3 3 4 2 4 2 2 1 2 2 2 1 1 2 2 3 3 4 7 3 2 8 4 0 92 8 8 11 3 3 3 3 3 2 13 13 4 4 2 5 2 1 2 3 1 2 2 2 1 1 1 1 1 1 2 3 2 9 4 2 1 1 2 2 1 2 2 2 1 2 2 1 1 1 2 1 1 2 4 4 15 9 8 7 12 14 5 6 2 4 9 19 1 5 4 5 16 5 19 27 17 6 6 25 7 3 2 2 2 5 100 9 2 2 3 2 2 8 11 6 5 39 5 5 2 2 2 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 4 3 16 8 4 2 2 3 4 5 20 16 29 37 98 7 5 4 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 76 76 m 2H \| 74 74 m 2H \| 37 37 dd 4H J 72 142 \| 18 17 h 2H J 71 \| 10 10 t 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOP(=O)(Cc1ccc(NC(=O)CCc2cnoc2-c2ccc(Cl)cc2)cc1)OCC	ir: 3 8 13 4 4 6 3 10 3 3 4 7 11 16 10 10 15 15 6 3 1 2 4 6 8 5 7 5 7 8 8 6 5 13 15 9 12 16 22 18 7 3 7 5 3 5 6 4 6 7 3 8 9 13 29 44 16 12 15 26 18 2 2 3 3 4 12 22 13 8 7 8 11 12 26 18 31 68 34 23 100 17 13 2 2 3 8 3 7 9 2 2 2 4 11 12 16 5 16 12 3 1 3 8 24 6 2 2 24 3 2 1 3 4 9 8 8 10 3 7 7 2 6 7 9 10 8 3 4 10 9 13 2 1 0 0 1 1 1 1 2 4 33 11 7 22 7 2 9 27 22 54 30 29 10 3 2 1 1 1 0 0 5 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 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 1 1 1 1 1 1 1 2 1 1 2 2 2 3 6 6 1 3 2 4 28 13 7 25 97 14 12 6 3 4 3 2 2 1 1 0 0 0 1 0 0 1 1 1 1 7 4 45 24 23 1 4 3 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; 1HNMR: 90 90 s 1H \| 83 83 d 1H J 10 \| 76 76 m 2H \| 76 75 m 2H \| 74 74 m 4H \| 43 42 dq 4H J 72 84 \| 33 32 dt 2H J 9 119 \| 31 30 td 2H J 8 83 \| 27 26 t 2H J 84 \| 14 13 td 6H J 7 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1cc(Cl)ccc1NCCCO	ir: 8 11 13 7 1 14 17 11 17 15 8 15 12 12 33 19 18 32 4 22 29 12 12 12 12 6 11 8 8 4 11 7 9 5 6 4 5 7 3 6 3 6 3 4 4 4 4 8 4 2 4 13 27 70 19 3 4 4 4 2 3 2 3 2 4 22 19 14 4 2 3 2 7 2 2 4 17 18 9 4 3 4 4 3 3 3 9 12 25 32 14 56 23 12 13 22 3 2 4 4 5 2 2 2 1 6 4 3 1 3 6 6 1 2 6 7 4 9 5 2 7 13 12 6 7 1 3 3 5 3 4 1 1 6 11 4 7 4 4 1 2 1 2 1 2 2 5 22 18 13 24 3 2 6 3 2 6 29 100 21 2 7 14 6 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 2 2 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 2 1 1 1 1 1 1 2 1 1 2 2 2 1 2 4 3 1 2 3 2 5 14 18 20 9 4 6 3 4 6 10 5 3 2 4 2 1 4 3 2 9 21 6 3 1 18 36 33 38 14 8 1 35 71 4 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 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; 1HNMR: 70 69 dd 1H J 22 84 \| 69 68 d 1H J 22 \| 67 66 d 1H J 84 \| 56 56 t 1H J 53 \| 45 44 s 2H \| 38 38 t 1H J 55 \| 36 35 q 2H J 55 \| 34 33 q 2H J 55 \| 18 17 p 2H J 55	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1=C2CCCC(=O)C2(c2ccccc2)CCC1=O	ir: 3 2 5 3 1 2 2 2 2 3 6 1 2 3 8 18 19 10 10 5 6 10 6 2 3 3 3 2 4 3 11 23 7 8 2 2 5 23 9 3 5 52 11 2 2 3 3 1 9 11 19 10 9 4 3 5 1 6 5 1 2 4 5 1 1 2 1 3 4 2 3 9 4 4 3 1 4 9 13 4 2 2 1 2 18 7 1 1 2 2 1 1 2 2 2 1 2 2 1 3 3 4 9 11 3 3 4 1 3 7 3 3 5 15 13 12 9 16 17 4 15 4 8 7 17 10 6 8 4 3 4 4 4 2 2 11 4 4 4 9 22 12 14 9 100 65 11 4 3 3 2 2 2 12 2 3 41 1 1 3 6 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 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 0 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 2 3 11 3 9 4 5 3 4 4 5 9 11 25 40 52 29 17 6 2 3 3 2 3 1 3 1 0 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 74 73 m 3H \| 73 72 m 2H \| 28 25 m 6H \| 24 23 ddd 1H J 54 81 137 \| 22 21 ddd 1H J 55 81 137 \| 19 19 t 3H J 11 \| 17 16 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@@H]1CC[C@@H](Oc2cc(C#N)ccn2)CN1C(=O)OC(C)(C)C	ir: 9 7 18 10 7 5 4 7 6 7 11 13 14 14 7 7 2 4 1 2 3 4 11 10 5 4 3 7 9 54 81 14 15 4 4 6 7 2 4 3 3 2 1 2 2 3 4 3 3 0 2 3 3 4 7 6 14 1 4 4 4 1 4 5 40 32 19 36 31 3 3 4 3 26 8 15 10 7 4 2 3 3 4 4 2 1 2 2 1 1 6 33 28 3 4 4 4 2 3 2 2 2 8 4 7 12 9 6 12 15 21 6 6 7 6 16 9 23 31 15 33 17 11 55 27 9 7 6 14 9 12 19 12 11 12 6 24 52 16 7 4 5 3 3 5 9 43 28 9 7 14 30 7 6 3 0 2 19 100 12 5 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 0 1 1 2 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 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 0 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 5 5 2 2 3 8 6 1 4 6 3 4 7 19 33 6 28 98 37 12 12 9 3 2 4 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 84 83 d 1H J 46 \| 73 73 dd 1H J 22 46 \| 68 68 d 1H J 22 \| 51 50 dddd 1H J 27 42 54 70 \| 42 41 pd 1H J 42 74 \| 40 39 dd 1H J 27 119 \| 38 37 dd 1H J 55 119 \| 22 21 dddd 1H J 42 55 84 131 \| 20 18 m 2H \| 17 16 dddd 1H J 54 71 84 124 \| 15 14 s 7H \| 12 12 d 3H J 75	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)c1[nH]c2ccc(NC(=O)C3(c4ccc5c(c4)OCO5)CC3)cc2c1S(C)(=O)=O	ir: 6 13 15 7 5 8 3 3 3 2 2 9 11 18 8 14 15 5 4 5 3 4 6 11 11 4 8 4 6 5 11 19 3 21 8 25 34 15 16 10 6 9 6 3 22 11 6 7 23 8 4 4 6 24 33 13 5 7 5 4 6 4 9 6 10 27 5 16 29 13 74 9 29 21 7 7 3 1 3 4 3 2 20 5 5 75 10 8 7 25 16 5 3 3 4 26 5 5 4 2 4 2 4 7 23 49 15 11 6 4 4 3 0 3 4 8 10 5 6 6 11 17 7 4 4 4 13 4 16 3 3 3 3 6 4 4 2 3 3 3 8 6 12 100 7 3 29 18 33 4 22 10 8 5 20 67 36 0 2 7 3 5 4 5 21 6 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 2 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 2 2 1 2 1 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 3 4 4 2 3 3 2 2 2 2 3 2 10 7 10 9 25 42 53 87 24 16 15 6 5 3 8 3 3 3 4 3 3 2 3 3 3 7 8 10 17 20 30 25 88 13 17 9 4 4 2 3 2 2 2 2 1 2 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 1 2 2 1 2 2 2 2 2 2 2 1 2 2 1 1 2 2 1 1 2 2 2 1 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 1 1 2 2 1; 1HNMR: 93 93 s 1H \| 82 82 d 1H J 24 \| 76 75 dd 1H J 22 73 \| 75 74 d 1H J 72 \| 70 69 m 2H \| 68 67 d 1H J 84 \| 59 59 s 2H \| 34 34 s 3H \| 17 16 m 2H \| 15 14 s 9H \| 14 14 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NC(Nc1ccc(Cl)cc1)C(Cl)(Cl)Cl)c1ccc(Br)cc1	ir: 2 3 4 4 5 19 16 7 11 7 2 4 6 4 6 6 8 8 8 11 5 3 3 3 2 6 3 7 7 6 4 3 3 2 2 2 5 3 3 5 50 32 18 5 5 3 4 4 2 1 2 3 3 3 26 5 5 1 2 2 1 0 2 2 2 10 3 3 8 14 2 1 2 2 1 1 2 2 1 3 3 2 1 2 1 4 3 9 5 2 2 1 1 2 2 1 2 6 3 1 1 1 1 2 0 37 4 5 5 6 13 9 4 4 5 5 3 8 4 3 4 3 2 3 5 4 2 2 2 2 2 1 2 1 1 2 1 3 4 13 10 11 49 10 77 5 4 13 97 37 13 1 9 13 4 1 2 2 1 1 1 4 7 3 2 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 1 2 4 5 4 15 44 19 9 8 4 3 2 2 2 1 2 2 2 2 1 2 1 4 2 3 2 3 6 13 63 100 56 6 3 3 2 2 2 1 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 2H \| 78 78 d 1H J 40 \| 77 77 m 2H \| 72 71 m 2H \| 67 67 m 2H \| 63 63 t 1H J 40 \| 58 58 d 1H J 38	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCOc1c(C)cc(OC(=O)c2ccccc2)cc1Cl	ir: 6 7 6 3 2 11 2 3 3 4 3 9 18 4 3 1 1 3 3 1 1 1 2 3 1 1 2 2 4 21 60 5 3 3 5 4 2 4 3 3 3 94 2 2 2 4 1 0 5 10 2 1 1 1 1 1 1 2 1 1 3 3 2 8 3 13 18 100 19 14 8 9 27 13 14 7 9 13 8 1 2 2 1 0 2 2 1 0 1 2 1 1 8 6 1 1 2 5 10 2 1 2 1 1 2 8 8 5 11 3 2 2 1 1 1 2 2 4 3 21 4 3 12 17 5 4 1 2 3 2 5 1 2 2 11 7 19 15 2 3 2 5 19 43 18 31 74 15 3 1 1 2 1 0 2 16 2 1 1 2 5 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 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 3 2 2 3 1 2 2 5 6 10 17 57 52 71 14 16 5 2 3 2 1 3 3 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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; 1HNMR: 81 81 m 2H \| 76 75 m 1H \| 75 75 m 2H \| 71 71 d 1H J 22 \| 69 69 d 1H J 26 \| 51 51 s 2H \| 35 35 s 3H \| 22 22 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cccc(N2C(=O)[C@@]3(C[C@H]3c3ccc(Cl)cc3)c3ccccc32)c1	ir: 3 5 9 17 2 3 2 6 4 3 2 6 5 7 1 1 0 2 3 6 1 1 1 0 0 1 1 1 2 3 7 21 6 4 3 2 6 4 3 0 1 7 10 75 4 2 7 37 6 1 4 1 1 2 18 32 6 2 1 2 2 2 1 1 1 4 2 7 3 11 4 2 1 2 7 6 4 2 6 1 3 2 3 2 3 2 7 5 4 1 6 2 1 2 4 12 2 7 3 7 2 1 1 1 4 2 0 2 1 1 0 1 1 2 4 18 6 2 2 4 4 7 9 5 4 2 1 6 7 2 1 2 2 38 8 2 1 4 26 18 9 2 7 6 19 10 100 6 10 19 12 14 26 24 5 9 4 1 5 2 3 1 3 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 2 1 0 1 4 4 2 5 20 26 51 43 3 9 7 4 1 2 2 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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: 81 81 t 1H J 22 \| 79 78 ddd 1H J 12 22 81 \| 76 76 ddd 1H J 12 22 75 \| 75 72 m 9H \| 39 39 s 2H \| 35 35 m 1H \| 25 25 dd 1H J 53 81 \| 23 22 dd 1H J 63 80	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C(CCCl)c1ccccc1	ir: 46 15 14 8 4 3 6 11 7 5 2 2 2 1 2 5 9 9 2 1 1 1 2 1 4 4 3 2 4 20 25 19 16 10 8 7 7 7 11 12 33 38 26 4 3 4 6 6 8 4 2 1 2 3 1 0 2 3 1 1 3 2 2 2 4 6 9 7 6 13 7 2 4 11 10 5 3 2 3 2 3 2 1 1 2 2 2 1 8 39 4 3 2 2 6 8 5 7 8 10 4 4 5 9 11 4 2 2 2 2 2 4 3 13 8 4 10 7 8 17 10 14 18 8 5 6 6 7 8 8 3 6 17 4 19 36 22 3 1 4 6 5 24 30 100 27 23 14 3 3 2 3 7 11 2 2 1 1 1 3 1 0 1 2 1 1 1 2 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 1 0 1 1 1 1 2 1 1 1 2 3 1 2 7 4 3 4 5 4 4 8 9 8 19 10 11 27 60 28 44 16 4 4 2 2 2 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 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; 1HNMR: 74 73 m 5H \| 37 36 m 3H \| 36 35 m 2H \| 24 23 ddt 1H J 36 73 132 \| 22 21 ddt 1H J 37 73 132	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1nnc2ccc(C=O)cn12	ir: 10 5 2 12 10 5 2 6 9 9 79 12 10 16 9 17 15 5 2 8 9 4 3 9 10 33 16 8 8 3 4 8 22 3 3 8 7 2 4 9 8 2 3 10 15 3 6 10 7 4 9 10 6 0 5 10 6 0 22 75 49 6 19 7 5 2 6 9 7 3 6 8 5 3 12 18 9 3 7 11 8 5 7 7 4 3 7 8 3 4 8 7 27 28 8 7 3 4 9 6 6 8 10 16 18 56 35 11 5 5 9 6 1 5 10 6 2 6 12 8 5 11 17 24 47 29 14 5 3 9 9 4 6 10 8 4 18 6 7 4 3 7 8 12 11 12 21 100 27 9 8 10 6 8 6 4 6 7 6 3 5 8 6 3 49 14 5 1 5 8 5 1 5 8 5 2 5 8 5 2 6 8 4 2 6 7 4 3 6 7 4 3 6 7 4 3 6 7 3 3 7 6 3 3 7 6 3 4 7 6 3 4 7 6 2 4 7 5 2 4 8 5 2 5 8 5 2 5 8 5 2 5 8 5 2 5 8 4 2 6 7 4 3 6 7 4 3 6 7 4 3 6 7 3 3 6 6 3 3 7 6 3 4 7 6 3 4 7 6 5 13 9 6 3 5 8 5 3 5 9 10 8 9 15 27 3 11 16 52 51 67 26 8 5 6 9 5 4 6 7 5 4 6 7 4 3 6 6 4 4 6 6 4 4 6 6 4 4 6 6 3 4 6 6 3 4 7 5 3 4 7 5 3 4 7 5 3 5 7 5 2 5 7 5 2 5 7 5 3 5 7 4 3 5 7 4 3 5 7 4 3 6 6 4 3 6 6 4 4 6 6 4 4 6 6 3 4 6 6 3 4 6 6 3 4 7 5 3 4 7 5 3 5 7 5 3 5 7 5 3; 1HNMR: 100 100 t 1H J 13 \| 91 91 m 1H \| 80 80 dt 1H J 13 90 \| 78 78 d 1H J 90 \| 35 35 p 1H J 65 \| 14 13 d 6H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=CC1(C=NO)CCC=C(C)C1	ir: 6 23 22 9 21 8 11 8 3 4 5 5 3 6 10 7 3 2 3 1 1 1 2 2 1 2 1 2 1 2 1 1 1 3 2 2 3 33 41 14 4 2 5 2 9 3 5 5 20 11 8 2 5 4 4 5 2 3 2 3 7 8 5 6 10 12 9 11 12 7 11 16 17 7 5 4 3 8 5 4 4 2 2 3 2 2 2 2 3 23 11 14 6 5 6 5 12 22 27 24 14 11 10 5 8 10 9 1 2 2 2 4 9 9 27 22 21 25 47 20 16 9 2 3 3 3 4 3 10 9 2 1 2 2 1 4 9 32 36 29 13 4 4 2 1 1 2 2 11 12 8 5 2 1 1 8 20 13 1 1 1 0 0 1 0 0 0 1 1 1 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 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 0 1 1 1 1 2 1 1 1 4 2 4 3 6 14 12 17 12 12 12 25 17 21 40 46 70 100 30 10 5 15 25 23 5 67 41 25 2 1 2 1 1 2 2 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 91 s 1H \| 76 75 h 1H J 9 \| 61 60 ddq 1H J 10 109 162 \| 54 53 ttq 1H J 9 19 48 \| 52 51 dd 1H J 24 163 \| 50 49 dd 1H J 23 109 \| 25 25 dp 1H J 10 146 \| 23 22 ddq 1H J 9 20 148 \| 21 19 m 2H \| 19 18 m 1H \| 18 17 dddt 1H J 9 27 55 116 \| 17 17 dt 3H J 11 20	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)Cc1ccc2c(c1)[nH]c1cc(-c3c(C)nnn3C)cnc12	ir: 4 8 5 1 3 5 5 6 7 4 10 3 2 1 1 3 2 2 1 8 1 2 13 23 4 4 2 3 4 22 3 3 2 3 6 1 30 15 2 4 2 1 1 1 1 1 1 1 1 1 1 1 3 8 5 14 10 3 1 1 1 3 4 4 4 5 4 15 22 4 3 2 1 2 4 2 1 0 1 1 1 1 1 1 1 1 6 13 5 1 7 10 2 2 4 1 1 3 2 3 9 8 5 3 2 18 5 1 2 2 5 15 3 2 3 4 2 4 5 5 16 6 10 7 8 10 9 9 8 51 2 3 5 1 2 1 1 2 2 0 1 15 3 20 100 14 8 8 11 1 1 12 18 2 1 10 5 2 1 1 1 0 2 1 3 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 1 0 0 0 1 1 1 0 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 3 1 2 2 2 1 3 2 2 5 4 2 5 3 15 19 24 11 53 8 14 6 6 1 0 2 7 4 2 1 1 1 1 2 3 2 1 2 2 1 3 6 3 3 17 50 24 5 4 3 2 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 0 1 0 1 0 0 1 0 0 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 87 86 d 1H J 16 \| 82 81 d 1H J 16 \| 80 80 d 1H J 87 \| 77 76 q 1H J 10 \| 73 72 ddt 1H J 9 15 86 \| 42 41 q 2H J 66 \| 41 40 s 3H \| 37 36 t 2H J 9 \| 24 23 s 3H \| 13 12 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCc1nc(-c2cccnc2)cn2c(C(Cc3c[nH]cn3)C(=O)OCC)nnc12	ir: 2 2 4 2 0 1 3 3 0 1 2 1 1 1 3 1 1 1 1 1 1 3 1 2 0 2 1 5 2 3 1 2 1 3 2 2 14 21 3 4 1 4 2 3 3 3 2 6 2 10 1 6 5 15 19 2 3 2 7 2 2 4 4 9 18 1 10 7 3 2 3 7 6 9 11 18 13 4 8 8 2 13 6 5 9 17 57 29 20 13 9 19 10 9 7 4 2 4 7 9 9 11 6 18 19 100 41 11 26 8 8 8 29 9 10 18 2 15 10 9 4 4 8 17 25 14 5 3 5 5 2 4 5 2 2 3 3 8 2 4 11 7 7 6 3 8 6 7 25 7 15 4 7 1 0 1 1 1 3 3 1 1 1 1 1 2 4 12 5 5 1 12 1 2 1 1 1 0 0 0 0 0 0 0 0 0 1 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 3 11 5 5 6 20 3 12 6 6 8 9 11 9 14 34 36 26 9 57 56 58 17 5 10 4 5 3 6 10 22 4 4 1 2 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: 92 92 t 1H J 17 \| 88 87 ddd 1H J 16 26 45 \| 86 85 s 1H \| 83 83 dt 1H J 23 73 \| 77 77 dd 1H J 16 59 \| 74 73 dd 1H J 49 73 \| 70 70 m 1H \| 51 51 t 1H J 76 \| 42 41 p 2H J 65 \| 33 33 m 1H \| 31 31 t 2H J 63 \| 31 30 ddd 1H J 7 75 152 \| 21 20 dd 1H J 48 59 \| 19 18 dtd 2H J 64 73 137 \| 12 11 t 3H J 63 \| 10 10 t 3H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCNC(=O)Nc1cc(-c2nc(C(F)(F)F)cs2)c(-c2cc(C(=O)OC)cnc2F)cn1	ir: 1 7 3 9 7 7 5 3 5 7 4 5 4 2 2 5 1 4 3 7 1 3 4 2 1 2 3 1 0 1 1 1 1 2 2 2 2 1 1 0 2 1 2 1 2 1 2 1 1 2 1 5 3 1 3 5 4 7 3 1 1 4 2 2 1 17 8 2 1 1 0 4 17 5 1 1 4 2 1 0 1 2 8 1 1 5 3 5 6 2 0 0 2 2 2 0 1 1 1 3 8 17 5 5 8 28 18 16 6 3 3 7 7 100 10 4 1 3 9 4 2 10 5 4 8 6 5 3 2 2 1 2 1 1 0 1 1 2 4 7 3 8 5 12 20 11 6 6 11 40 4 8 2 6 22 5 4 2 1 1 1 1 0 1 1 1 1 1 1 0 1 3 14 3 1 1 0 0 11 2 0 0 0 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 2 3 4 2 1 1 1 1 2 1 1 3 4 2 4 4 19 5 29 49 19 4 2 2 2 1 1 0 4 2 1 0 1 1 0 2 1 2 3 1 3 2 7 20 24 4 5 3 2 2 1 1 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 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 89 89 dd 1H J 17 38 \| 88 88 s 1H \| 88 87 dd 1H J 16 37 \| 86 86 d 1H J 20 \| 82 81 m 2H \| 64 64 t 1H J 37 \| 39 39 s 2H \| 33 32 qd 2H J 37 61 \| 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.
Cn1c(CBr)c(Br)c(=O)n1-c1ccccc1	ir: 2 2 3 2 2 3 3 2 3 2 3 7 4 3 2 2 2 2 5 2 2 2 2 2 2 2 4 6 4 10 5 7 7 5 4 11 11 19 24 65 27 8 11 5 2 3 3 3 3 11 4 2 3 6 4 2 2 3 2 2 2 2 3 2 2 2 3 8 10 9 10 2 5 3 5 4 7 4 7 4 5 12 6 4 3 3 2 2 2 2 2 2 3 4 2 2 2 2 2 2 6 19 4 4 3 2 2 2 3 3 2 5 4 5 2 2 2 2 2 3 2 4 2 4 3 3 3 5 4 4 3 4 3 4 10 24 97 3 2 2 3 2 8 4 8 3 10 2 3 3 4 5 3 9 79 16 4 0 2 3 9 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 4 3 2 3 2 2 2 5 4 6 8 12 13 100 21 8 7 7 3 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 75 75 m 2H \| 74 74 m 2H \| 74 73 m 1H \| 43 43 s 2H \| 33 32 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Nc1cc(Oc2ccc(NC(=O)C3(C(=O)Nc4ccc(F)cc4)CC3)c(F)c2F)ccn1	ir: 4 4 7 6 6 4 4 5 3 5 4 5 5 9 3 8 5 8 19 6 6 5 6 6 4 4 5 6 12 7 7 9 18 14 15 19 5 13 3 4 7 5 4 6 7 6 36 24 6 4 3 5 7 2 4 91 13 8 7 4 2 3 2 4 6 17 7 9 11 6 3 4 9 15 6 2 1 1 1 1 1 1 1 2 1 3 2 3 2 5 5 3 2 5 7 2 3 1 1 1 4 4 2 3 14 1 2 3 5 5 2 1 3 4 2 3 10 2 1 1 1 1 2 1 2 2 2 1 2 4 1 1 0 1 1 0 2 5 21 6 3 3 5 6 7 7 7 16 42 41 100 31 15 46 13 3 4 2 4 3 17 29 6 4 2 1 1 1 1 0 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 1 0 0 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 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 1 0 0 0 1 1 0 0 1 1 0 1 1 1 2 2 1 4 10 20 42 26 4 12 7 2 1 1 2 1 1 3 2 1 1 1 3 3 10 27 7 4 12 30 67 30 7 1 3 7 9 41 4 1 1 1 1 1 1 0 1 1 1 1 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 100 100 d 1H J 31 \| 89 89 s 1H \| 81 80 d 1H J 48 \| 78 77 dd 1H J 48 95 \| 75 75 m 2H \| 72 71 m 2H \| 69 68 dd 1H J 48 95 \| 67 66 dd 1H J 22 48 \| 60 59 m 3H \| 19 19 m 2H \| 17 16 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1ccc(C(=O)C(c2ccccc2)c2ccccc2)c(C(C)C)c1OS(N)(=O)=O	ir: 8 13 25 6 2 4 2 3 4 6 10 20 6 2 2 7 4 2 3 12 2 1 1 1 1 3 1 2 4 6 3 9 10 7 9 3 5 5 8 7 25 14 3 3 2 3 2 4 2 2 4 2 2 12 4 9 9 2 2 5 3 1 3 2 2 2 2 7 8 20 3 29 35 13 7 18 21 20 9 5 9 9 16 31 18 26 13 37 19 43 18 30 10 30 10 6 8 8 9 4 4 3 1 4 5 11 9 3 4 8 2 3 3 2 2 4 7 36 38 21 10 10 8 5 6 5 4 8 8 17 3 7 3 4 6 37 5 7 5 13 9 6 13 9 15 7 5 3 2 2 1 1 9 5 2 1 1 1 1 2 3 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 2 3 3 8 4 4 7 8 14 19 16 66 19 4 6 3 2 3 1 2 3 5 1 1 2 2 3 1 8 30 69 22 15 11 8 42 100 15 8 6 4 1 2 2 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0; 1HNMR: 78 77 s 2H \| 75 75 d 1H J 84 \| 74 73 m 8H \| 73 73 m 2H \| 72 71 dd 1H J 7 86 \| 57 56 s 1H \| 38 37 p 1H J 69 \| 32 32 pd 1H J 6 67 \| 14 13 d 6H J 70 \| 13 12 d 6H J 68	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(Nc1nc2ccccc2n1CC1CNC1)c1ccc(C(F)F)s1	ir: 6 5 7 9 6 7 7 8 8 6 6 9 6 5 5 6 7 7 5 8 7 6 5 6 7 7 5 6 5 11 10 7 6 10 7 7 8 7 6 7 7 8 16 21 9 7 9 9 19 38 93 30 18 23 9 18 32 14 8 10 16 36 16 7 10 11 10 7 7 18 31 9 10 15 9 12 5 7 8 7 5 4 6 8 7 6 24 25 13 10 7 6 11 6 5 6 7 6 6 17 8 9 0 100 42 12 14 7 22 7 17 7 7 7 8 7 11 11 12 7 10 9 11 11 6 6 7 18 4 6 7 4 4 8 7 5 3 10 37 17 5 7 9 8 65 11 11 13 25 2 11 13 12 93 28 25 7 37 14 4 5 7 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 6 6 5 4 5 6 5 4 6 6 5 4 5 6 4 4 6 6 5 5 6 6 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 7 6 5 4 5 6 4 4 6 6 4 4 6 5 4 5 6 5 5 5 6 6 5 5 6 6 5 6 7 7 8 6 8 8 5 19 54 44 25 37 10 6 5 5 5 5 6 5 6 5 5 5 7 7 5 8 40 17 22 27 14 16 16 14 8 6 6 7 5 5 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 5 5 4 5 5 5 4 5 5 5 5 5 5 5 5 5 5 4 5 5 5 4 5 5 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4; 1HNMR: 79 78 d 1H J 88 \| 76 75 m 1H \| 75 74 m 1H \| 73 72 m 2H \| 72 71 m 1H \| 66 66 d 1H J 7 \| 42 41 d 2H J 51 \| 33 32 dt 2H J 34 108 \| 31 30 dt 2H J 33 108 \| 24 23 tt 1H J 32 51 \| 16 15 p 1H J 34	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCCn1c2nc[nH]c2c(=O)n2c(CNC(=O)c3ccccc3)nnc12	ir: 15 10 14 23 26 15 10 13 13 12 12 13 14 12 17 10 22 14 6 8 6 5 10 4 2 9 7 4 10 18 31 32 79 16 20 16 10 7 13 13 27 100 45 14 11 9 5 1 3 6 6 5 6 7 8 6 12 7 12 13 13 13 9 17 12 10 10 4 21 13 10 15 10 9 11 7 9 14 14 10 30 10 4 6 6 4 4 3 5 4 4 8 10 15 6 6 14 8 14 22 85 48 42 12 15 17 15 47 44 45 72 30 28 33 11 13 12 44 51 49 34 16 10 13 32 18 16 11 19 18 11 12 15 9 14 10 22 24 36 49 35 58 18 35 15 10 9 14 31 31 12 12 6 8 4 6 4 2 3 5 4 1 3 6 4 2 5 5 3 0 3 5 3 0 3 5 3 0 3 5 2 1 3 5 2 1 4 5 2 1 4 5 2 1 4 4 2 1 4 4 2 1 4 4 2 2 5 4 1 2 5 4 1 2 5 3 1 2 5 3 1 3 5 3 1 3 5 3 0 3 5 3 1 3 5 3 0 3 5 2 1 4 5 2 2 4 5 2 1 4 4 2 2 4 5 2 2 5 4 2 3 5 5 1 4 6 5 3 4 5 6 5 13 24 34 12 14 17 5 13 14 18 17 35 78 31 41 51 52 44 11 6 9 7 8 4 5 6 17 8 7 6 5 3 6 6 5 4 14 17 12 16 41 28 8 6 5 5 2 3 4 4 2 2 4 3 2 3 4 3 1 3 4 4 1 3 5 3 1 3 4 3 1 3 4 3 1 3 4 2 1 3 4 2 1 3 4 2 1 3 4 2 2 3 4 2 2 3 4 2 2 4 4 2 2 4 3 2 2 4 3 2 2 4 3 1 2 4 3 1 2 4 3 1 3 4 3 1 3 4; 1HNMR: 84 83 d 1H J 59 \| 81 81 t 1H J 52 \| 78 78 m 2H \| 75 75 m 1H \| 75 74 m 2H \| 49 49 d 2H J 53 \| 43 42 m 2H \| 19 18 m 2H \| 14 13 m 5H \| 9 9 t 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(N2CCN(C(=O)CCl)C(C)C2)c(F)cc1Cl	ir: 2 2 3 3 3 2 3 3 4 3 2 3 3 5 7 6 4 4 2 7 6 3 2 2 3 2 5 11 9 11 4 3 3 6 3 3 2 3 3 6 2 2 3 2 9 7 3 3 4 7 2 3 2 6 2 2 2 2 4 3 4 4 4 12 12 4 7 4 14 8 4 3 2 2 2 2 3 6 2 3 2 2 6 4 2 2 3 3 4 12 8 3 4 4 5 4 3 8 11 13 9 4 6 7 10 3 5 5 2 2 4 2 2 12 5 4 3 9 6 7 4 5 10 6 2 3 6 4 5 4 6 4 5 4 3 3 4 8 5 3 6 3 2 2 3 4 11 100 3 4 4 4 44 0 2 3 2 1 2 2 2 2 10 4 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 2 2 2 2 2 2 2 2 2 3 3 2 3 4 3 3 3 4 3 3 3 4 7 17 12 6 57 7 4 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 71 70 d 1H J 121 \| 65 65 d 1H J 42 \| 45 44 qt 1H J 46 70 \| 40 39 m 3H \| 39 38 s 2H \| 38 37 m 1H \| 37 36 m 4H \| 14 13 d 3H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1CCN(Cc2cccc(C(=O)NC3CC(F)(F)C3)c2)CC1	ir: 3 5 9 7 7 7 5 8 2 5 8 11 8 6 6 3 2 2 4 1 3 5 6 5 2 8 4 1 2 3 2 2 2 3 3 3 2 11 6 100 25 8 11 3 3 3 3 1 7 4 2 1 2 3 4 2 3 3 3 1 2 5 3 2 2 4 4 2 3 5 1 4 3 3 2 5 4 6 5 12 9 11 3 6 42 9 6 5 8 4 2 3 12 7 4 2 4 3 3 6 14 4 2 3 5 3 2 7 18 5 4 7 31 28 3 5 7 13 6 7 9 11 20 11 3 5 4 8 6 7 9 7 15 10 6 25 13 5 4 4 5 2 2 7 9 6 16 18 12 48 33 39 7 3 3 2 2 1 1 2 2 1 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 2 1 0 1 2 1 0 2 2 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 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 0 2 2 2 3 1 2 4 2 4 4 4 1 4 5 4 6 38 8 18 60 13 4 3 1 3 3 2 0 2 2 1 0 2 2 1 1 2 3 4 3 7 5 11 27 25 10 5 2 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 1 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; 1HNMR: 79 78 tq 1H J 8 17 \| 78 77 m 1H \| 74 73 m 2H \| 72 72 d 1H J 68 \| 42 41 m 1H \| 36 36 d 2H J 8 \| 34 33 m 4H \| 26 25 m 6H \| 23 22 dtd 2H J 46 126 158 \| 15 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc(-c2ncc(Br)cc2N)c1	ir: 10 1 2 4 25 37 12 3 5 9 4 3 0 5 2 11 3 2 3 14 4 2 2 3 0 3 2 2 2 2 9 7 1 1 2 2 1 2 2 25 6 3 2 1 1 1 2 4 9 1 1 2 1 1 1 1 1 1 1 1 1 2 1 1 1 3 13 3 5 3 3 1 2 1 1 2 2 2 3 1 1 4 1 2 1 1 0 1 4 3 2 12 3 2 1 1 1 1 0 0 1 1 0 1 2 1 0 0 1 1 1 3 2 1 0 1 1 1 1 4 1 1 0 1 1 3 1 1 1 1 0 7 14 1 1 0 0 0 1 1 2 1 1 0 1 1 35 2 1 1 2 13 23 1 4 3 19 1 1 3 28 2 6 3 1 1 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 0 1 1 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 1 0 0 0 1 1 1 0 0 0 1 0 0 0 0 0 1 1 1 1 1 1 1 1 1 1 0 1 1 1 2 2 2 1 3 71 7 2 1 1 1 1 0 0 0 1 0 0 0 1 0 0 1 2 100 5 1 0 1 1 1 0 2 2 3 7 78 0 2 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 1 1 1 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 83 83 d 1H J 16 \| 75 75 ddd 1H J 12 21 86 \| 74 74 d 1H J 18 \| 74 73 m 2H \| 69 68 ddd 1H J 12 22 81 \| 48 48 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.
CC=C(C(=O)OCC)c1csc(NC(C)=O)n1	ir: 10 5 22 6 14 6 13 4 5 4 2 4 6 6 4 14 6 4 2 2 1 3 4 7 12 4 3 3 3 3 8 8 5 12 23 10 7 1 2 1 2 2 5 7 3 5 2 2 2 2 4 14 3 6 1 4 7 22 8 8 21 15 7 10 6 3 5 13 12 9 11 12 8 7 26 8 5 8 6 2 3 3 1 2 4 6 26 7 2 1 4 7 9 4 3 5 13 5 1 2 4 5 4 4 31 23 9 6 6 5 4 10 15 35 19 13 6 15 6 6 10 9 11 16 25 32 10 14 29 12 7 15 37 12 5 7 3 2 0 2 1 1 1 3 5 9 11 25 75 7 12 2 4 1 1 1 1 0 1 1 1 0 0 1 1 1 1 1 1 1 1 13 1 2 8 1 1 1 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 0 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 1 0 1 1 0 1 3 1 2 7 6 10 4 5 4 3 4 4 9 9 7 9 16 13 71 74 47 23 32 100 36 9 11 5 3 2 1 1 2 1 1 2 1 1 1 1 1 1 2 6 9 12 23 36 4 4 4 2 1 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 q 1H J 64 \| 70 70 s 1H \| 43 42 q 2H J 71 \| 22 22 s 3H \| 21 20 d 3H J 64 \| 13 13 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)[C@@H](CC(C)C)NCc1ccccc1	ir: 3 2 1 0 2 2 1 1 0 1 0 0 1 1 1 0 2 1 1 0 0 0 0 0 2 1 1 1 2 3 4 3 1 1 1 1 1 9 8 13 16 4 7 7 18 8 3 2 4 10 2 1 2 1 2 2 2 1 2 2 14 3 7 8 6 0 3 3 8 10 4 1 1 2 3 5 1 2 6 2 3 3 1 1 0 0 0 1 1 3 0 0 0 1 0 2 7 4 4 2 1 1 1 1 3 6 3 4 6 8 4 6 4 7 12 3 1 2 1 4 4 2 2 4 1 1 1 1 2 2 6 4 3 4 3 7 8 4 4 1 1 2 4 2 7 2 2 1 1 0 1 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 3 1 1 1 7 3 5 5 11 5 2 1 0 1 1 1 1 1 1 0 0 1 0 0 1 1 4 100 11 1 2 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; 1HNMR: 74 73 m 2H \| 73 72 m 1H \| 72 72 ddt 2H J 8 15 75 \| 40 39 ddt 1H J 9 54 141 \| 39 38 ddt 1H J 9 55 143 \| 37 37 s 2H \| 35 34 m 1H \| 26 26 dt 1H J 54 73 \| 18 16 m 2H \| 14 14 ddd 1H J 68 77 137 \| 9 9 d 3H J 63 \| 9 8 d 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)Cc1cc(=O)nc2n1C[C@@H](COc1ccc(C3CCCCC3)cc1)O2	ir: 2 6 12 11 2 10 9 9 12 8 19 9 2 8 16 11 10 26 10 4 6 11 8 3 5 17 7 2 4 6 6 3 3 6 7 4 6 7 17 25 5 10 18 0 3 10 8 0 3 10 6 4 12 44 17 7 9 13 7 5 8 13 5 2 6 11 8 15 28 17 12 2 6 9 5 5 7 8 2 1 6 7 3 1 6 9 17 12 11 9 3 4 8 9 4 3 10 6 4 7 11 22 9 9 14 14 4 8 15 8 12 17 16 8 2 15 12 6 8 8 18 10 11 15 15 12 15 14 8 10 8 10 16 9 4 9 8 6 4 8 33 22 6 9 13 89 33 9 80 20 11 7 10 5 4 9 8 1 4 12 100 6 9 7 5 0 3 7 4 0 4 7 4 0 4 8 3 0 4 7 3 0 4 7 3 1 5 7 3 1 5 6 2 1 5 6 2 2 5 6 2 2 6 5 2 2 6 5 1 3 6 5 1 3 6 4 1 3 7 4 1 3 7 4 1 3 7 4 0 4 7 4 1 4 7 3 1 4 7 3 1 5 6 3 1 5 6 3 2 5 6 2 2 5 6 2 2 5 6 2 2 6 5 2 3 6 5 2 3 6 6 3 4 8 8 6 6 8 10 6 6 14 9 13 33 37 65 44 27 25 17 7 7 10 7 2 4 7 3 2 5 6 3 2 5 6 3 2 5 6 2 2 5 5 2 2 5 5 2 2 5 5 2 3 6 5 1 3 6 4 1 3 6 4 1 3 6 4 1 3 7 4 1 4 6 3 1 4 6 3 1 4 6 3 1 4 6 3 2 5 6 3 2 5 5 2 2 5 5 2 2 5 5 2 2 5 5 2 3 5 5 2 3 6 4 2 3 6 4 1 3 6 4 1 3 6 4 1 4 6; 1HNMR: 71 71 m 2H \| 68 68 m 2H \| 59 58 t 1H J 14 \| 50 49 tdd 1H J 15 33 46 \| 44 44 m 1H \| 42 41 m 2H \| 40 39 dd 1H J 33 103 \| 27 26 m 1H \| 25 25 dd 2H J 13 63 \| 21 20 m 1H \| 19 18 ddt 2H J 57 82 132 \| 17 15 m 5H \| 15 14 m 4H \| 10 9 dd 6H J 9 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCC[C@H](C)Oc1nc(N)c2nc(OC)n(CCCCC3CCCNC3)c2n1	ir: 1 2 2 2 3 2 3 2 6 2 3 2 3 3 2 3 2 4 3 2 2 4 2 4 2 2 4 2 3 6 2 5 2 5 4 2 9 7 4 4 11 9 3 4 3 1 2 3 2 4 1 2 5 2 6 2 7 5 2 3 1 2 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 1 1 2 7 1 2 5 2 1 1 1 1 1 2 11 2 2 1 3 3 1 1 0 1 1 1 1 2 5 3 4 3 6 6 12 3 7 6 6 6 10 4 2 4 8 3 3 2 5 17 4 15 6 2 0 1 1 1 1 1 1 1 2 1 2 4 11 11 8 5 3 5 8 100 17 9 11 31 5 2 1 1 1 1 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 1 1 1 1 2 2 1 1 1 1 2 1 1 2 4 9 1 2 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 3 1 6 18 42 69 7 2 4 2 1 2 1 1 3 7 71 4 1 1 1 0 0 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: 70 70 s 2H \| 46 45 h 1H J 65 \| 43 42 t 2H J 74 \| 40 39 s 2H \| 29 29 ddd 1H J 41 49 125 \| 28 27 m 2H \| 27 26 ddd 1H J 41 49 125 \| 25 24 tt 1H J 40 49 \| 19 18 m 3H \| 17 12 m 15H \| 12 11 dtd 1H J 62 81 130 \| 9 9 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C(C#N)CC/C(=N\[S@](=O)C(C)(C)C)c1cccc(OC)c1	ir: 9 22 22 16 11 14 6 5 6 5 9 7 4 6 9 12 4 5 7 3 3 2 4 4 15 19 9 9 4 5 2 2 5 5 5 11 2 3 3 1 1 15 13 24 8 5 28 26 20 14 5 2 6 18 7 5 8 6 6 5 8 7 8 13 14 28 26 13 26 22 13 15 12 20 10 4 15 11 1 2 3 5 4 1 2 2 1 1 2 2 1 1 3 3 10 5 8 4 1 3 3 1 0 4 7 8 4 4 7 6 15 11 5 8 23 11 24 34 13 20 12 12 8 20 6 7 13 7 9 21 6 11 5 3 5 27 68 12 14 10 10 40 14 11 92 6 2 4 3 1 1 4 5 6 3 28 4 1 1 3 2 5 3 3 1 0 1 2 2 0 1 2 1 0 1 2 1 0 2 15 1 1 1 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 3 4 4 4 3 5 22 10 6 4 5 8 10 9 19 33 20 14 100 56 18 6 2 3 3 2 1 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 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 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2; 1HNMR: 77 77 ddd 1H J 10 21 75 \| 74 73 dd 1H J 73 81 \| 70 69 m 2H \| 43 42 q 2H J 63 \| 38 38 t 1H J 62 \| 38 38 s 3H \| 29 29 t 2H J 64 \| 25 24 dq 1H J 63 127 \| 22 21 dq 1H J 64 126 \| 14 13 t 3H J 63 \| 13 13 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCN(CC)C(=O)c1ccc(Br)cc1C(=O)C(F)(F)F	ir: 10 4 3 3 3 5 2 9 8 1 0 2 3 1 0 4 5 1 1 9 4 1 1 2 3 1 1 3 3 1 4 3 3 2 1 19 6 3 2 6 20 17 2 8 4 3 4 5 2 1 2 3 3 11 20 6 16 1 4 4 2 3 4 11 2 1 2 3 6 5 3 4 2 1 2 3 1 1 2 3 5 1 3 3 5 9 10 7 4 9 3 3 3 12 4 5 2 3 16 52 10 3 3 2 1 2 3 2 1 11 3 2 1 9 15 2 4 11 15 15 6 2 5 9 40 8 16 2 1 3 4 9 12 9 4 3 1 2 3 3 10 47 23 15 5 14 8 32 6 13 3 1 2 3 2 1 2 2 2 0 1 5 2 1 1 3 2 0 1 3 2 0 2 3 1 0 2 3 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 1 1 3 2 0 1 3 1 0 2 3 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 5 2 1 1 3 2 2 2 4 3 1 2 11 13 2 5 100 22 6 2 2 2 2 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 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 1 2 1 1; 1HNMR: 82 82 dd 1H J 9 17 \| 78 78 m 2H \| 35 34 q 4H J 71 \| 12 12 t 6H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)N1CCC(c2cn(-c3ccc(N)cc3)c3ccccc23)CC1	ir: 8 16 14 13 9 12 15 6 5 3 6 6 4 3 3 1 2 2 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 1 2 2 11 8 3 1 1 1 1 1 2 1 2 2 3 16 5 5 3 3 1 2 2 1 3 3 1 1 1 7 1 1 1 1 1 2 2 9 11 2 1 1 1 1 1 1 2 2 2 2 1 1 1 1 2 1 1 1 6 1 1 1 2 1 5 1 10 2 1 1 1 3 2 1 2 1 3 5 5 2 3 4 3 3 6 2 2 5 3 2 2 2 2 1 3 2 2 3 4 2 1 1 1 4 6 3 1 1 1 3 4 37 5 14 18 6 13 100 21 7 3 0 1 2 13 1 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 1 1 2 2 3 1 2 2 3 7 11 6 17 9 4 6 1 2 1 1 1 1 1 1 1 1 1 1 1 4 13 12 4 4 1 1 1 1 1 2 1 6 24 24 6 5 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 79 78 m 1H \| 76 76 dd 1H J 15 65 \| 74 73 ddd 1H J 13 64 75 \| 73 73 d 1H J 8 \| 72 72 m 2H \| 72 71 td 1H J 13 72 \| 68 67 m 2H \| 41 41 s 2H \| 38 37 ddd 2H J 57 84 123 \| 36 35 ddd 2H J 59 85 123 \| 32 31 m 1H \| 22 21 m 2H \| 19 18 m 2H \| 15 14 s 7H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)/C(C)=C/[C@@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C	ir: 27 13 38 11 2 8 8 4 5 17 9 12 13 13 8 4 7 45 13 8 18 20 6 4 7 35 23 92 63 80 13 10 9 6 4 5 3 3 1 3 2 1 2 3 2 1 2 4 3 2 5 5 3 8 90 0 5 5 3 0 3 22 5 4 2 8 3 3 4 7 6 8 6 2 6 2 2 1 7 3 3 2 3 2 5 4 27 11 2 2 2 4 4 38 4 4 0 4 11 13 2 2 2 1 2 2 7 5 4 5 6 5 5 19 4 5 4 9 16 33 17 13 22 17 8 6 5 5 12 24 9 14 8 6 3 3 3 4 3 2 3 3 5 18 22 98 100 49 10 25 11 10 11 2 1 1 1 2 2 1 3 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 0 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 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 1 1 2 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 1 1 2 1 1 0 1 2 3 4 5 1 1 3 6 3 3 4 5 5 3 6 19 39 40 39 60 6 11 11 3 2 2 2 2 1 2 1 3 1 1 1 1 1 1 2 1 3 13 14 92 60 5 5 3 1 1 1 1 1 1 1 1 0 0 1 0 0 1 0 0 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 74 74 m 2H \| 73 72 dt 2H J 9 81 \| 66 65 m 1H \| 54 53 d 1H J 77 \| 48 47 dtdd 1H J 10 53 64 75 \| 42 41 q 2H J 71 \| 31 30 ddq 1H J 9 63 134 \| 28 28 ddq 1H J 9 63 134 \| 19 19 t 3H J 12 \| 14 14 s 7H \| 12 12 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2c(c1)N(C)C(=O)CN=C2c1ccccc1	ir: 4 4 2 2 1 1 2 2 0 3 4 4 2 3 26 3 2 2 2 2 5 2 4 2 8 6 4 1 3 6 14 6 1 6 5 0 2 16 5 3 8 100 1 1 1 2 1 1 2 2 1 0 2 4 14 8 2 2 3 1 1 2 1 1 3 14 9 7 9 6 4 1 3 3 3 2 2 2 2 1 1 1 1 1 2 1 2 1 2 3 1 1 2 1 0 1 2 1 0 1 2 3 2 1 2 1 0 1 2 5 5 2 2 1 2 3 9 4 4 3 11 5 12 9 9 7 2 3 8 2 2 3 5 2 8 2 1 1 1 9 42 8 3 8 41 18 2 6 24 2 2 9 3 10 4 18 2 0 1 2 1 0 1 6 4 1 1 1 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 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 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 2 2 0 1 2 2 1 1 2 1 1 1 2 3 4 8 11 20 45 14 14 4 1 1 2 2 0 1 2 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1; 1HNMR: 76 75 m 2H \| 75 74 m 5H \| 69 69 m 2H \| 43 43 s 2H \| 38 38 s 3H \| 36 36 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)CCOc1ccccc1F	ir: 1 1 0 2 3 4 2 3 3 3 7 8 12 4 1 6 8 4 13 30 69 88 59 50 8 10 3 1 1 2 2 1 1 2 1 1 1 3 5 2 2 13 31 36 10 11 5 4 2 1 2 1 1 1 1 1 1 1 1 0 1 1 1 0 4 2 1 2 4 8 4 6 3 2 6 9 9 8 12 22 5 4 9 3 6 7 10 7 4 4 3 1 1 2 1 2 2 1 1 1 1 1 1 2 1 1 0 1 2 2 2 3 8 10 3 2 3 2 2 4 8 4 3 2 5 1 1 1 1 2 2 3 6 5 4 1 3 4 1 2 3 9 32 21 7 4 1 2 4 2 2 1 0 0 1 0 0 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 2 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 1 1 0 1 1 1 1 1 3 2 1 1 2 2 1 1 1 1 1 2 8 7 2 14 7 16 1 2 2 1 0 2 12 89 100 25 10 2 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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; 1HNMR: 73 71 m 2H \| 71 70 td 1H J 16 86 \| 69 68 ddd 1H J 12 36 89 \| 44 43 t 2H J 63 \| 28 27 t 2H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=C[C@@H]1CC[C@@H](CCC)CC1	ir: 1 0 0 1 1 1 3 0 2 1 0 0 0 0 0 0 0 1 2 1 0 1 2 0 2 4 11 11 38 10 23 11 6 5 2 4 2 1 1 6 2 9 2 2 2 1 1 1 1 0 2 3 9 7 7 2 7 6 7 3 1 1 2 5 6 3 6 4 7 30 42 48 63 63 20 12 12 10 5 3 5 3 2 2 2 1 2 1 3 2 10 15 7 3 5 5 3 2 2 2 9 31 13 16 100 46 24 60 55 27 21 14 8 9 6 2 8 12 12 11 18 12 29 10 25 9 5 7 7 5 7 20 13 6 6 17 21 54 68 11 15 10 4 3 5 1 2 1 1 1 0 1 1 1 1 2 1 4 2 5 2 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 1 1 1 1 0 1 1 0 0 1 1 1 1 1 2 3 10 7 6 10 14 23 24 23 11 72 25 54 27 73 64 91 49 18 23 24 69 17 15 4 13 16 6 2 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 58 57 m 1H \| 52 51 dt 1H J 20 163 \| 50 49 dt 1H J 21 110 \| 22 21 m 1H \| 16 15 ddtd 2H J 9 44 69 123 \| 15 14 m 1H \| 14 14 m 2H \| 14 13 m 3H \| 14 12 m 1H \| 13 11 m 4H \| 9 8 m 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)n1	ir: 12 4 4 12 23 7 6 4 4 6 7 22 14 22 6 8 6 5 5 3 4 2 3 2 3 1 3 4 3 1 1 6 6 7 9 5 3 1 2 19 11 10 4 4 3 2 3 10 17 20 5 5 2 1 2 3 2 0 2 3 4 2 6 4 8 3 4 4 2 1 2 3 1 2 8 7 6 4 3 5 5 3 7 3 1 1 4 3 3 2 3 3 2 4 7 7 1 2 6 5 9 4 7 7 6 7 9 4 0 3 5 5 3 13 9 4 4 3 8 12 8 10 11 18 30 12 23 15 14 8 11 17 5 20 12 17 19 68 15 6 5 6 5 4 1 3 3 1 4 10 100 32 8 5 3 11 27 20 4 1 2 3 2 0 1 2 2 0 1 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 0 1 2 2 0 1 2 1 0 1 3 1 0 1 2 1 0 1 3 1 0 1 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 3 6 3 2 2 4 3 2 3 5 6 2 6 13 32 19 11 37 11 3 3 3 3 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0; 1HNMR: 79 78 m 2H \| 73 72 m 1H \| 39 39 s 2H \| 39 38 m 2H \| 38 37 m 2H \| 32 32 pd 1H J 6 66 \| 15 14 s 8H \| 14 14 s 5H \| 14 13 d 7H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)=CCCNC(CC1CCCCC1)C(O)CC(C(=O)NCC(C)C)C(C)C	ir: 5 5 1 4 5 6 3 4 6 4 2 4 6 5 1 6 15 5 7 10 13 14 18 24 20 19 11 9 18 9 19 19 28 11 7 6 14 12 31 40 15 12 9 19 15 24 21 30 23 14 12 12 32 6 12 11 9 4 18 17 16 2 10 6 8 0 10 12 7 5 9 7 4 8 7 6 7 3 8 6 6 5 5 14 3 3 3 5 2 2 4 4 5 4 8 7 7 11 18 19 23 30 34 20 28 14 14 27 31 14 23 13 10 11 17 19 7 14 14 14 7 17 16 13 13 12 10 5 3 11 10 9 31 16 8 7 5 7 6 4 4 7 5 6 18 14 53 14 16 10 5 1 1 5 3 1 2 7 3 1 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 4 2 0 2 3 2 1 2 3 1 1 2 3 1 1 3 3 1 1 3 3 1 1 3 3 1 1 3 3 1 2 3 3 1 2 3 2 1 2 4 3 1 2 4 2 0 2 3 2 1 2 3 2 0 2 3 2 1 2 4 2 1 3 3 2 1 2 4 2 2 3 3 2 1 3 3 2 1 3 3 2 1 3 3 1 2 3 3 1 2 4 3 3 7 6 3 3 5 7 6 5 7 10 7 5 7 18 35 12 12 11 10 18 44 42 18 8 4 6 3 2 3 5 2 2 4 5 5 5 16 100 75 40 32 33 32 12 11 7 3 3 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 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 3 2 1 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 64 63 t 1H J 59 \| 52 51 m 1H \| 43 43 dt 1H J 46 77 \| 37 36 qd 1H J 51 73 \| 35 35 d 1H J 50 \| 32 31 m 2H \| 29 28 m 1H \| 28 27 m 2H \| 25 24 m 1H \| 22 20 m 3H \| 19 18 m 2H \| 17 14 m 16H \| 14 13 m 2H \| 13 12 m 1H \| 12 11 ddt 2H J 58 86 128 \| 9 8 m 12H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C1=C(C)N=C(N)C(C)(C(=O)OCC)C1c1ccccc1	ir: 10 3 3 3 4 4 3 7 11 7 18 19 18 9 13 12 7 6 3 2 2 1 4 5 1 1 1 1 1 1 2 1 4 2 1 2 1 1 3 1 11 2 3 10 2 1 1 1 1 1 1 1 1 0 1 1 1 1 1 2 1 1 1 2 1 1 3 1 2 3 5 3 3 2 4 3 2 2 2 5 3 5 7 4 1 1 1 1 1 1 3 3 4 1 1 1 1 1 5 3 2 2 1 1 1 1 1 1 4 4 26 8 10 5 17 4 7 2 3 2 2 2 1 4 2 3 2 2 1 4 4 3 1 1 2 8 1 1 2 4 18 4 2 7 5 12 3 2 1 1 1 1 2 1 1 2 6 9 1 0 1 1 1 1 1 1 2 6 8 93 17 1 2 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 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 2 2 2 3 10 14 8 4 10 6 2 3 3 3 39 15 1 2 1 1 1 2 2 8 100 33 2 6 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 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 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0; 1HNMR: 74 73 m 3H \| 73 72 m 2H \| 60 60 s 2H \| 48 47 ddq 1H J 9 16 25 \| 43 41 m 2H \| 42 41 q 2H J 71 \| 25 24 d 3H J 11 \| 14 14 d 3H J 14 \| 13 12 m 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)CCC(=O)N1CCN(c2ncccn2)CC1	ir: 2 3 3 5 2 6 2 5 9 4 4 12 8 5 5 9 6 9 6 22 29 37 19 19 14 3 7 7 5 6 3 3 2 4 2 2 7 2 3 3 4 3 4 7 6 6 2 1 2 5 6 22 72 66 100 13 6 15 6 7 4 2 3 3 2 3 3 3 2 1 2 3 2 1 5 12 10 27 41 42 9 7 3 3 6 7 6 3 4 2 3 2 2 2 2 2 2 5 5 3 2 3 3 2 4 5 5 3 3 4 7 2 3 7 5 4 3 5 9 10 10 11 17 7 13 5 36 13 9 8 4 4 5 6 6 5 8 13 10 12 13 16 20 22 31 31 77 39 30 4 4 11 12 49 92 81 12 4 2 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 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 1 1 1 2 3 4 3 3 2 2 4 2 3 5 9 6 5 7 12 13 5 1 0 1 3 1 5 34 32 39 5 2 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 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 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: 84 83 d 2H J 44 \| 65 65 t 1H J 45 \| 38 37 q 8H J 18 \| 26 26 d 1H J 26 \| 26 26 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCC(=O)c1c(-c2ccccc2)c2cc(Cl)ccc2c(=O)n1Cc1ccc(S(C)(=O)=O)cc1	ir: 10 3 3 4 4 7 5 6 4 33 22 24 8 8 3 18 8 13 5 6 8 3 2 3 12 2 2 5 4 14 16 19 10 13 13 11 39 7 4 42 4 0 3 5 6 32 25 28 14 10 9 1 15 7 16 12 13 6 10 14 11 6 3 8 23 94 10 27 11 25 7 7 2 1 1 3 12 3 7 3 3 19 4 12 40 15 4 6 6 10 11 8 12 52 7 10 4 1 3 8 1 4 3 23 55 7 24 4 6 2 3 2 2 9 9 2 3 3 9 18 13 53 41 18 19 9 22 8 3 11 1 1 4 12 15 21 8 19 13 18 17 17 1 2 3 5 4 25 8 5 4 82 6 7 1 5 18 10 1 1 2 2 12 9 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 0 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 2 2 4 1 3 3 5 4 3 2 1 3 5 15 25 21 33 47 100 88 10 9 31 5 3 2 1 2 4 2 1 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 80 80 d 1H J 88 \| 79 78 d 1H J 25 \| 78 77 m 2H \| 76 76 dd 1H J 25 89 \| 76 74 m 8H \| 52 52 t 2H J 9 \| 33 32 s 2H \| 28 28 t 2H J 92 \| 17 16 tt 2H J 68 91 \| 14 13 h 2H J 73 \| 9 9 t 3H J 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccc(CCc2oc(-c3ccc(C(F)(F)F)cc3)cc2CO)cc1	ir: 2 2 2 4 2 2 6 3 5 3 2 1 2 3 2 5 14 3 4 3 4 12 3 2 1 2 1 1 1 1 1 2 2 1 2 3 1 3 1 1 1 1 1 0 1 1 1 0 1 3 2 5 5 7 26 100 16 2 2 1 1 0 3 3 1 3 2 2 2 6 3 4 1 2 1 1 3 2 2 2 8 2 3 4 17 26 18 14 24 8 5 2 3 5 3 14 9 4 40 9 17 2 1 1 3 5 1 1 2 1 0 5 76 4 5 5 5 5 4 2 2 3 3 7 15 13 11 17 6 2 3 1 0 1 4 3 1 1 1 0 0 1 2 2 3 3 5 14 16 5 4 3 6 4 1 1 1 0 0 1 1 0 1 1 1 1 1 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 2 1 1 3 2 1 1 2 1 1 4 10 5 6 44 46 15 10 5 8 6 6 40 43 6 3 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 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 78 77 m 2H \| 77 76 dq 2H J 13 108 \| 71 71 m 2H \| 70 70 dt 2H J 8 82 \| 67 67 t 1H J 9 \| 46 46 dd 2H J 9 57 \| 36 35 t 1H J 57 \| 30 29 m 2H \| 29 29 dddd 2H J 10 20 61 70 \| 24 23 d 3H J 10	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCNC(=O)c1ccc2c(c1)N=C(c1ccc(Cl)cc1)c1ccccc1S2=O	ir: 3 1 2 2 3 4 3 2 7 5 3 4 9 3 2 4 10 37 8 5 6 5 7 6 8 4 1 2 2 1 2 10 18 7 8 6 5 7 21 29 24 10 24 18 7 5 4 4 2 1 2 4 3 6 11 19 5 2 3 6 3 0 4 11 4 7 4 8 7 17 4 2 1 1 2 4 1 2 2 3 2 1 2 7 4 2 16 4 1 2 4 2 0 1 2 2 2 2 8 4 8 1 2 1 0 1 4 3 8 6 4 3 0 5 7 6 16 9 13 12 5 6 4 8 8 16 8 6 8 4 2 2 3 8 4 10 12 4 10 8 40 4 15 18 61 27 43 55 16 13 5 3 3 4 6 2 4 4 6 5 1 2 1 2 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 2 1 1 1 1 1 0 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 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 3 2 2 2 2 2 2 1 2 3 4 4 4 19 30 37 100 51 5 9 7 3 2 3 3 2 0 2 2 2 2 2 2 2 2 3 6 4 9 20 13 21 11 7 3 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 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 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 82 82 d 1H J 82 \| 82 81 m 2H \| 81 80 dd 1H J 14 73 \| 79 78 dd 1H J 16 68 \| 77 77 td 1H J 16 71 \| 77 76 td 1H J 15 70 \| 76 76 m 3H \| 76 75 m 2H \| 34 33 td 2H J 49 56 \| 16 15 p 2H J 61 \| 14 13 h 2H J 66 \| 10 9 t 3H J 67	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCc1ccc(N)cc1Br	ir: 17 43 2 32 18 12 5 3 4 6 4 10 10 2 0 3 2 2 3 5 3 3 1 3 2 2 2 3 6 3 2 4 3 3 3 3 3 3 2 3 3 1 2 2 2 3 3 4 2 1 2 4 3 3 19 10 4 0 2 3 2 0 2 2 1 1 14 16 6 0 2 2 1 1 2 2 1 1 3 19 5 6 4 2 1 1 2 3 1 1 2 2 8 7 3 3 1 1 2 2 0 1 2 2 0 1 4 19 3 1 2 3 1 2 3 2 1 2 2 1 0 1 2 1 1 2 2 1 1 2 2 1 0 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 2 4 18 12 34 84 4 3 2 2 3 50 25 2 3 2 1 1 2 1 0 1 2 1 1 1 2 1 0 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 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 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 2 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 2 1 2 3 2 1 3 6 4 5 4 29 11 2 1 2 1 1 2 2 1 1 1 2 1 1 2 2 2 59 28 14 2 1 1 1 1 1 1 1 3 100 33 4 3 1 2 2 1 1 2 3 1 1 2 1 1 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 71 70 dt 1H J 9 79 \| 68 68 d 1H J 22 \| 66 65 dd 1H J 22 77 \| 37 37 s 2H \| 28 27 qd 2H J 9 73 \| 13 12 t 3H J 73	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(OCc1ccccc1)[C@H](CC(F)CI)N1C(=O)c2ccccc2C1=O	ir: 2 4 7 5 8 7 5 4 2 3 3 3 2 3 3 3 3 4 3 2 3 3 3 2 2 3 3 3 3 5 10 9 5 3 3 3 4 4 10 21 100 31 7 0 2 5 4 5 2 4 3 1 3 4 3 1 2 4 5 3 3 6 5 1 4 4 6 4 10 6 3 6 3 5 4 2 6 4 5 2 3 3 2 3 3 3 2 2 4 14 3 2 4 4 2 4 8 8 6 3 5 4 2 2 4 3 2 3 5 5 3 5 7 16 8 6 9 6 2 6 6 7 7 5 6 5 7 6 5 3 3 27 16 9 6 8 7 3 10 3 4 2 7 26 4 7 5 4 3 2 2 4 5 5 53 4 3 2 2 14 3 1 2 4 3 1 2 4 3 1 2 4 2 1 2 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 3 2 2 3 3 2 2 3 2 2 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 2 3 3 2 2 3 3 2 2 3 3 2 2 4 4 4 4 5 3 3 5 8 4 5 15 8 13 48 11 8 5 2 3 4 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 2 3 3 2 2 3 3 2 2 3 3 2 2 3 2 2 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 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; 1HNMR: 79 79 dd 2H J 32 51 \| 77 77 dd 2H J 31 51 \| 74 73 m 4H \| 73 73 m 1H \| 52 51 m 3H \| 50 50 tt 0H J 39 53 \| 49 49 tt 0H J 38 53 \| 35 34 ddd 1H J 40 119 172 \| 32 31 ddd 1H J 40 119 172 \| 25 24 dddd 1H J 55 62 139 168 \| 23 22 dddd 1H J 53 60 137 168	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cnc(Cl)cc1-c1cccc(NCc2cccc(F)c2)n1	ir: 3 7 7 10 5 6 6 7 4 7 6 7 22 15 10 15 10 10 3 14 10 22 12 6 5 4 9 10 12 10 4 12 11 6 26 33 9 9 3 4 4 6 2 3 8 0 44 48 37 6 6 7 3 4 9 4 5 6 8 4 2 4 3 38 11 9 10 15 20 7 2 3 2 2 2 2 3 5 7 7 10 7 11 4 4 3 2 2 6 8 2 2 2 7 3 3 3 2 9 6 3 2 3 3 2 8 21 15 10 4 3 3 4 2 3 4 4 12 10 4 6 5 9 6 8 4 13 11 8 8 7 7 12 8 3 5 8 5 5 16 28 100 21 8 21 52 6 16 24 5 5 6 6 17 31 25 21 31 9 5 7 5 2 2 2 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 2 2 1 2 4 3 5 6 16 24 58 87 21 12 5 2 2 2 3 2 0 2 2 1 0 1 3 1 0 3 3 2 2 6 9 17 82 40 12 6 3 2 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 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 0 1 1 1 0 1 1 1 0; 1HNMR: 82 82 s 1H \| 77 77 t 1H J 75 \| 76 76 s 1H \| 74 73 m 2H \| 72 72 ddq 1H J 11 21 77 \| 72 71 dtd 1H J 10 21 121 \| 71 70 dddd 1H J 12 21 79 101 \| 66 66 t 1H J 53 \| 65 65 dd 1H J 13 77 \| 47 46 dt 2H J 9 53 \| 41 40 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cn1c(C(F)(F)F)c(C(=O)O)c(=O)n1-c1ccccc1	ir: 1 2 4 1 1 1 2 1 2 4 6 1 7 4 2 3 19 4 4 1 6 95 2 3 2 2 1 2 1 4 9 4 1 2 3 1 2 3 5 4 11 9 2 4 15 15 2 1 1 11 10 2 1 1 1 1 1 0 1 1 1 12 1 1 2 4 1 1 8 19 2 1 2 4 3 7 5 9 40 9 2 2 1 1 2 3 6 3 1 1 1 2 2 1 5 1 2 3 100 18 0 1 2 1 1 1 1 1 6 36 2 1 2 1 1 2 1 4 2 2 1 2 1 2 1 1 1 1 1 1 2 2 7 15 5 7 5 1 1 1 1 1 2 2 43 5 0 2 1 1 32 7 3 1 1 1 2 31 2 2 8 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 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 1 1 1 2 4 2 4 9 8 11 9 4 1 2 1 1 1 13 4 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 75 75 m 3H \| 74 73 m 4H \| 35 35 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CNC(=O)c1c(C(N)=O)nc2n1C1CC(C1)c1cc(F)c(C#CC(C)(O)CO)cc1-2	ir: 3 4 6 7 3 4 4 4 1 5 5 3 1 7 4 5 9 5 6 5 11 13 24 10 10 20 9 10 16 7 5 4 7 6 6 7 9 10 25 41 30 19 9 4 4 9 13 5 2 6 5 3 3 8 6 1 4 5 3 1 3 7 3 2 4 5 14 16 11 6 3 2 3 5 6 11 13 15 9 5 4 5 4 3 9 9 11 16 17 14 5 7 11 21 9 5 11 5 6 6 5 3 6 5 8 4 10 6 5 13 4 4 4 3 2 3 3 5 3 3 3 4 3 4 7 5 6 4 3 20 6 3 5 4 5 15 28 17 4 5 6 15 6 12 8 55 6 4 4 2 2 4 5 0 32 6 3 23 4 1 32 100 4 6 2 1 2 4 2 2 2 3 2 1 2 3 3 1 2 3 2 1 2 3 2 1 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 2 2 2 1 2 3 2 1 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 3 2 2 3 2 2 2 3 3 2 2 3 2 2 3 4 5 3 3 6 4 5 5 4 10 25 10 5 4 4 4 4 22 82 26 10 5 2 3 4 2 2 3 4 5 10 7 5 19 22 17 12 6 4 3 3 3 5 7 55 17 4 4 3 2 2 2 3 2 2 2 2 2 2 2 2 2 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 1 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 1 2 2; 1HNMR: 80 80 d 1H J 47 \| 74 73 q 1H J 46 \| 72 71 d 1H J 7 \| 71 71 s 3H \| 46 46 p 1H J 47 \| 43 43 s 1H \| 38 37 dd 1H J 62 104 \| 36 35 t 1H J 61 \| 35 35 dd 1H J 61 105 \| 34 33 m 1H \| 29 29 d 3H J 46 \| 25 24 dt 2H J 49 114 \| 22 22 dt 2H J 48 115 \| 16 15 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)N[C@@H]1CCc2c(ccc(OCc3ccccc3)c2C(=O)OC)[C@H]1O	ir: 9 5 13 17 17 16 5 4 5 4 5 4 5 5 4 3 5 6 17 13 9 12 28 18 13 8 20 40 22 23 38 21 16 8 12 9 11 7 13 3 50 6 3 3 2 4 2 3 2 5 4 1 2 6 15 7 5 2 2 3 4 2 2 9 3 4 4 5 3 7 5 3 2 6 15 4 3 4 4 1 2 1 1 1 2 2 2 12 15 20 11 6 8 15 9 23 38 43 6 10 9 3 9 8 7 8 12 11 17 7 45 9 5 3 3 2 2 3 3 1 5 8 6 5 10 7 15 4 4 3 1 2 4 5 8 17 2 2 3 3 6 5 21 24 11 27 13 5 8 31 4 9 4 9 5 3 1 1 1 1 9 1 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 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 0 0 0 1 0 1 1 1 1 0 1 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 1 1 2 1 2 3 2 2 1 4 3 2 8 16 8 14 34 43 25 31 100 45 18 3 7 3 1 1 1 1 1 1 0 1 1 1 1 1 2 6 49 5 5 2 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 73 m 4H \| 73 73 m 1H \| 72 71 m 1H \| 68 68 d 1H J 84 \| 58 58 d 1H J 93 \| 51 51 t 2H J 9 \| 50 49 m 1H \| 42 40 m 4H \| 39 39 s 2H \| 31 30 ddd 1H J 66 92 167 \| 30 29 ddd 1H J 66 92 167 \| 23 22 m 1H \| 20 19 ddt 1H J 65 91 134 \| 12 12 t 3H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
FC(F)(F)c1n[nH]c2ncc(Br)cc12	ir: 3 10 15 1 2 1 1 1 1 1 0 1 1 1 2 13 2 1 1 1 1 4 3 0 1 1 1 0 1 1 2 3 3 1 1 1 1 1 6 6 47 100 2 1 1 1 1 0 0 1 1 3 1 1 1 0 1 1 1 0 1 2 13 2 1 1 3 15 4 1 1 1 0 1 1 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 2 1 1 22 27 4 1 13 33 11 84 5 4 7 2 1 0 1 1 1 0 1 1 1 0 1 1 1 2 16 1 1 1 2 2 1 0 1 15 3 1 1 1 0 0 1 1 8 1 1 1 0 0 1 2 20 3 1 1 1 1 2 19 7 3 22 6 2 3 2 14 5 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 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 2 1 1 1 1 2 13 7 1 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 0 1 0 59 36 62 21 2 1 1 2 3 1 1 1 2 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 88 88 s 1H \| 87 86 d 1H J 16 \| 85 85 d 1H J 16	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C=C=CC1CCC(=O)N1	ir: 15 9 2 9 16 12 9 11 17 33 13 25 10 6 3 15 21 17 19 40 41 35 41 41 56 15 12 15 18 6 4 12 9 3 4 12 10 1 4 11 9 2 4 19 17 7 11 18 11 1 5 14 7 0 6 15 7 4 8 16 7 3 8 13 6 1 10 12 5 1 8 12 5 2 10 12 4 2 9 11 3 2 9 11 3 4 11 10 3 3 10 10 2 4 11 9 1 5 16 13 4 5 11 7 2 6 14 11 5 13 40 16 5 19 32 13 0 8 13 6 1 15 15 15 8 17 22 8 4 19 32 27 28 11 13 4 2 9 11 3 2 10 10 2 6 15 12 2 3 10 11 17 31 92 91 57 14 13 10 2 5 11 7 1 5 11 6 1 6 11 6 0 6 12 6 2 7 13 5 1 7 10 5 1 7 10 4 2 7 10 4 2 8 9 3 2 8 9 3 3 9 8 3 3 9 8 2 4 9 8 2 4 10 7 1 5 10 7 1 5 11 6 1 5 11 6 0 6 11 6 1 6 11 5 1 6 10 5 1 7 10 5 2 7 10 4 2 8 10 4 3 8 9 4 3 8 9 3 4 9 8 4 4 10 8 3 4 9 7 2 5 10 8 4 6 13 9 6 8 13 15 16 11 30 15 18 31 20 14 3 11 16 9 5 10 12 7 4 9 10 6 3 8 10 5 6 11 11 11 10 35 100 36 69 27 18 4 5 9 8 3 5 10 8 3 4 10 7 3 5 10 7 2 5 10 6 1 5 10 6 1 6 10 6 1 6 10 5 2 6 10 5 2 7 9 5 2 7 9 5 3 8 9 4 3 7 8 4 3 8 8 4 4 8 8 3 4 8 7 3 4 9 7 3 5 9 7 2 5 9 6 2 5 9 6 2 5 10 6 2; 1HNMR: 69 69 d 1H J 62 \| 52 51 dt 1H J 9 56 \| 48 48 d 2H J 31 \| 39 38 dddd 1H J 24 34 59 69 \| 22 21 ddd 1H J 49 68 148 \| 21 21 ddd 1H J 49 67 148 \| 19 18 m 1H \| 15 14 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(S(=O)(=O)N2CC=CCC(COCc3ccccc3)C2C(=O)O)cc1	ir: 4 4 4 5 5 7 10 5 9 4 9 23 10 8 6 4 6 5 7 17 17 45 37 8 5 6 11 6 5 5 7 7 6 10 19 19 4 7 10 29 32 4 5 3 7 5 5 3 3 3 3 3 3 5 9 70 4 4 3 4 7 9 8 21 11 6 3 4 8 6 4 4 6 7 8 10 6 13 20 20 7 6 12 14 45 92 27 8 10 11 5 5 5 7 4 7 15 13 14 7 6 6 10 3 3 5 4 3 6 8 6 5 4 3 3 3 3 6 14 12 7 4 6 5 9 8 7 4 3 3 6 5 3 3 5 11 3 4 4 4 4 3 7 24 14 3 7 5 4 6 5 3 4 3 3 6 3 2 2 3 3 16 3 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 3 2 2 2 3 3 2 3 3 3 4 3 8 10 14 40 52 14 6 6 5 3 1 4 7 2 100 5 0 3 4 3 2 3 3 2 2 3 3 2 2 2 3 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 88 88 s 1H \| 77 76 m 2H \| 74 73 m 5H \| 71 70 m 2H \| 58 57 dtt 1H J 9 51 102 \| 55 54 ddddd 1H J 8 17 60 70 99 \| 45 44 m 2H \| 42 42 d 1H J 103 \| 41 40 ddq 1H J 9 51 148 \| 39 39 ddq 1H J 9 51 150 \| 38 38 s 2H \| 38 37 dd 1H J 60 112 \| 35 35 dd 1H J 60 113 \| 28 27 m 1H \| 23 22 m 1H \| 21 20 m 1H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(NC(=O)N1C(=O)Cc2cc(Br)ccc21)c1ccccc1	ir: 1 5 4 3 1 3 2 1 1 2 3 2 1 2 2 11 2 2 2 1 1 3 2 1 2 21 2 2 4 7 6 1 0 13 2 5 4 2 2 4 2 1 1 3 17 2 2 2 2 1 2 2 2 2 4 5 2 1 6 3 3 93 7 3 21 4 5 3 5 44 3 2 2 2 1 1 2 3 5 7 2 2 2 5 3 3 2 3 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 2 4 4 2 2 1 1 2 2 2 2 2 3 2 2 2 1 1 2 3 4 2 2 3 2 6 2 2 2 8 2 2 1 1 2 2 3 4 26 2 3 3 3 20 5 6 6 29 17 25 100 17 52 4 1 2 16 54 4 2 1 2 2 2 1 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 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 2 2 2 2 3 2 2 2 2 2 2 4 5 7 8 75 19 10 7 3 2 2 3 1 2 2 1 1 2 2 2 2 2 2 3 2 3 7 21 7 11 10 8 17 7 3 2 1 2 2 1 1 2 2 2 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 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; 1HNMR: 79 78 m 2H \| 76 75 m 6H \| 74 74 dd 1H J 23 89 \| 38 38 d 2H J 11	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(C[C@H]2NC(=O)n3c2nc2cc(Br)ccc23)cc1	ir: 0 2 4 4 1 3 4 8 13 5 4 2 2 3 2 1 1 2 5 19 9 3 2 1 1 2 2 1 1 2 2 1 3 3 3 1 33 12 9 6 6 4 1 1 1 2 1 0 2 3 3 0 2 25 22 16 8 2 3 3 2 3 2 2 2 2 4 12 7 7 2 5 3 1 2 1 2 2 2 1 1 2 2 2 1 1 2 3 2 3 2 1 1 1 1 2 2 16 5 4 2 1 1 1 6 1 1 1 1 1 1 2 4 4 1 2 2 1 2 2 3 4 2 8 10 3 1 2 2 1 1 4 1 1 1 1 1 1 1 1 1 1 5 4 3 9 2 6 21 6 10 7 12 10 3 2 1 2 2 45 33 3 3 2 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 1 2 4 2 3 4 2 5 3 35 100 25 8 5 2 3 2 2 1 2 1 1 1 1 1 2 2 2 2 2 2 2 2 3 8 16 3 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 80 79 d 1H J 21 \| 78 77 d 1H J 87 \| 77 77 dd 1H J 22 86 \| 71 70 dt 2H J 9 86 \| 69 68 m 2H \| 64 64 d 1H J 64 \| 54 54 q 1H J 60 \| 38 38 s 2H \| 33 32 ddt 1H J 9 57 149 \| 30 29 ddt 1H J 9 57 148	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1c(N)nc2c(c1N)Cc1ccc(OCC(=O)O)cc1O2	ir: 7 28 25 7 18 10 4 8 16 8 7 6 3 9 8 13 4 7 9 24 35 59 3 10 5 4 2 4 3 2 13 4 4 3 3 4 3 2 3 5 4 3 4 15 8 18 12 5 5 4 5 15 24 4 5 6 3 1 2 4 3 1 2 4 2 2 4 11 5 6 6 4 2 1 3 3 10 10 20 28 6 4 5 7 6 5 7 5 1 2 2 2 2 2 3 4 10 3 5 3 2 2 2 2 1 2 2 2 1 2 2 2 1 3 4 2 2 3 3 4 1 3 6 3 2 5 3 5 3 5 4 1 2 5 3 2 2 2 2 2 2 4 5 13 8 4 10 4 7 15 5 8 4 11 8 24 4 22 100 60 7 0 12 3 2 1 2 2 2 2 1 2 2 2 1 2 2 2 1 1 2 1 4 2 2 2 1 2 2 2 1 1 2 2 1 1 2 2 1 1 2 2 2 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 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 1 1 1 2 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 6 4 2 3 9 5 2 2 2 2 1 2 2 2 6 3 2 1 1 2 2 2 19 7 2 2 1 2 2 2 1 2 3 2 41 58 7 3 2 2 1 2 2 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 2 1 1 1 1 2 2 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 1 1; 1HNMR: 71 70 dt 1H J 9 86 \| 67 66 dd 1H J 24 86 \| 65 65 d 1H J 23 \| 58 58 s 2H \| 47 46 s 2H \| 41 41 d 2H J 9 \| 25 24 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC(=O)c1ccc2[nH]nc(-c3cccc(NC(=O)Cc4ccc(F)cc4)c3)c2c1	ir: 1 1 1 1 1 2 2 4 5 3 7 3 3 4 2 3 3 4 4 2 7 5 3 4 8 7 2 3 5 12 44 16 6 3 5 7 6 4 4 28 22 2 6 2 1 3 4 14 6 3 4 2 3 6 6 31 7 4 3 1 1 1 1 1 1 1 1 2 7 4 1 1 2 2 2 2 1 1 1 2 1 1 4 1 2 1 4 2 4 1 1 2 2 1 1 3 2 2 7 1 2 2 9 2 4 3 2 2 3 25 2 1 1 1 2 1 1 1 3 2 1 1 2 2 3 4 6 2 14 4 1 1 1 1 1 1 1 5 1 2 1 1 1 3 12 45 14 9 26 7 2 3 3 4 7 4 4 9 26 15 3 3 1 0 2 4 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 1 1 1 1 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 2 2 1 1 1 2 1 1 2 4 3 8 13 100 7 5 2 4 4 2 1 2 2 2 3 2 1 2 2 1 29 11 3 2 2 2 8 59 9 5 8 11 4 8 10 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 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; 1HNMR: 95 94 s 1H \| 88 88 d 1H J 14 \| 80 79 t 1H J 21 \| 79 78 dd 1H J 15 75 \| 77 77 d 1H J 75 \| 77 76 dt 1H J 19 73 \| 76 75 m 2H \| 74 74 s 2H \| 74 73 ddt 2H J 9 35 81 \| 71 71 m 2H \| 37 37 t 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(-c2nnc(Cl)c3ccccc23)n1	ir: 7 4 2 6 8 4 5 4 5 3 1 5 5 4 0 4 6 1 0 5 6 0 41 33 26 6 7 8 20 5 3 6 5 2 2 4 4 2 3 4 4 3 46 56 22 44 20 15 9 8 3 5 3 0 2 5 3 1 3 6 3 3 6 5 8 10 10 5 4 3 6 9 8 4 4 4 3 2 8 11 7 9 9 5 4 2 5 5 1 2 4 7 2 2 4 3 1 2 4 4 2 3 6 6 4 3 5 4 0 2 5 3 0 3 5 4 2 5 5 39 13 5 10 8 3 15 16 7 19 18 8 2 0 6 12 6 2 39 94 84 21 10 7 5 4 4 4 3 4 4 5 3 5 9 23 27 17 8 9 7 4 4 4 2 3 7 4 1 3 4 2 1 2 4 2 1 2 4 2 1 3 3 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 4 2 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 1 3 3 1 1 3 3 1 1 3 3 1 2 3 3 1 2 3 3 2 3 4 3 2 3 4 4 2 3 5 4 2 7 7 5 9 29 38 100 47 12 7 5 3 3 5 2 2 3 4 2 2 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 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 1 2 3 2 1 3 3 2 1 3 3 2 1 3 3 2 1 3 3 2 2 3 3 2 2 3 3 1 2 3 3 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 83 82 m 1H \| 82 81 m 1H \| 80 80 dd 1H J 11 82 \| 78 78 dd 1H J 74 81 \| 77 76 m 2H \| 75 74 ddt 1H J 8 15 75 \| 26 26 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCc1cc(N)nn1Cc1cc(Cl)ccc1OCC(C)C	ir: 10 15 7 2 7 5 5 3 3 5 3 5 4 12 39 15 13 11 6 8 5 4 7 4 4 3 3 3 3 2 4 5 3 4 2 4 5 5 3 4 5 5 2 2 8 6 2 1 2 2 2 2 4 15 9 3 3 3 5 4 6 5 2 4 2 3 9 13 5 4 4 4 8 12 9 3 4 4 2 7 13 3 3 2 7 4 3 3 2 2 2 1 2 4 4 3 2 3 5 6 3 3 1 2 3 2 1 2 9 12 4 2 2 4 4 4 3 4 5 5 5 3 5 2 4 5 3 4 4 4 2 3 3 4 4 13 8 4 7 4 3 23 14 17 3 1 1 3 6 3 10 22 78 22 11 7 6 33 100 5 3 6 4 0 2 4 2 0 1 3 2 1 1 2 1 1 2 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 2 2 3 2 3 2 3 4 4 5 2 4 20 7 14 33 41 81 5 3 2 1 2 2 2 1 1 1 2 2 1 2 4 25 14 4 2 2 2 2 2 2 2 1 4 50 60 7 2 2 2 2 1 1 2 2 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 73 73 dt 1H J 9 24 \| 72 72 dd 1H J 26 90 \| 68 67 d 1H J 91 \| 55 55 d 1H J 9 \| 54 53 d 2H J 10 \| 39 38 s 2H \| 38 38 d 2H J 51 \| 27 26 qd 2H J 8 76 \| 20 19 dtt 1H J 50 72 144 \| 13 12 m 3H \| 10 10 d 6H J 72	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(N[C@@H]1CC[C@H](CNc2cc(-c3ccc(F)cc3)n[nH]2)CC1)c1cc(C(F)(F)F)ccc1Cl	ir: 11 54 40 34 25 8 14 19 21 34 7 10 6 7 3 6 19 10 5 5 2 3 5 6 28 38 11 5 1 3 3 7 7 5 5 6 5 6 5 10 10 5 41 67 30 6 21 29 57 47 15 5 58 24 27 70 12 3 2 2 1 3 2 3 2 1 2 9 10 19 6 5 19 21 12 5 16 4 5 3 4 1 4 1 1 1 3 15 3 3 1 3 21 10 2 4 3 2 26 28 14 45 16 28 8 8 3 23 13 65 14 18 12 37 64 16 13 13 8 25 16 23 8 14 8 27 18 42 5 8 2 4 5 4 2 33 6 4 10 43 26 6 4 19 13 24 46 92 67 23 19 53 16 11 7 9 3 3 3 2 25 25 15 6 75 5 1 1 1 3 1 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 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 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 1 1 1 1 0 1 1 0 0 1 0 0 0 1 1 1 2 1 1 1 1 1 2 1 3 4 1 2 2 4 2 7 4 5 5 2 4 12 28 15 43 87 67 56 20 4 4 6 4 3 7 7 3 3 3 3 1 2 8 10 6 10 18 33 24 37 66 100 86 32 14 8 7 4 2 3 3 1 1 2 1 1 1 1 1 1 1 0 1 1 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 91 90 s 1H \| 81 81 dq 1H J 13 25 \| 77 76 m 1H \| 76 76 d 1H J 74 \| 76 75 m 2H \| 75 75 m 2H \| 72 72 d 1H J 88 \| 63 62 t 1H J 52 \| 61 61 s 1H \| 36 35 dddd 1H J 35 63 88 95 \| 35 34 dt 1H J 51 125 \| 34 33 dt 1H J 51 125 \| 20 19 m 2H \| 18 16 m 5H \| 15 14 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COCC(=O)C(=Cc1ccc(F)c(F)c1)C(=O)OCCC#N	ir: 6 6 3 4 3 4 3 2 1 1 2 1 3 8 3 5 7 2 2 1 1 1 3 4 5 5 3 3 1 2 5 2 2 2 2 2 3 22 18 64 16 9 4 4 3 7 2 4 3 1 2 2 1 2 6 8 7 2 3 3 5 1 2 2 4 10 13 12 5 4 3 1 1 3 11 7 2 1 1 1 1 1 1 1 1 1 2 11 1 1 1 1 1 5 8 5 1 8 6 1 1 1 1 1 1 3 11 1 4 4 4 2 3 5 14 10 3 2 3 8 2 2 10 7 11 5 5 6 4 4 2 1 1 1 1 1 1 1 1 1 4 6 21 5 2 4 15 14 10 100 9 7 12 2 2 1 2 3 5 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 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 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 1 1 1 2 3 5 4 3 1 1 2 2 1 6 12 20 12 11 22 11 8 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 80 80 s 1H \| 75 74 m 2H \| 73 72 td 1H J 46 99 \| 45 45 t 2H J 54 \| 44 43 s 2H \| 34 33 s 3H \| 28 28 t 2H J 54	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc(CN(CC#Cc2ccc(F)c(C#N)c2)C(=O)c2cc(Cl)c[nH]2)c(OC)c1	ir: 7 8 11 10 9 12 21 11 13 9 14 14 19 10 13 7 7 8 9 6 6 8 7 7 5 9 6 6 6 7 6 6 7 9 7 7 6 10 9 27 23 25 48 18 24 38 24 5 11 16 14 10 9 31 28 10 12 14 9 5 7 8 7 7 10 17 24 43 23 29 10 7 8 8 6 9 13 8 7 7 7 7 12 7 8 8 8 12 11 8 7 5 8 6 7 7 10 16 24 21 12 10 7 7 8 7 5 6 8 6 5 5 8 5 4 6 7 7 10 15 14 13 17 11 26 20 35 38 16 12 6 13 16 34 11 9 6 6 6 9 11 24 7 12 50 7 7 13 18 0 38 17 92 14 15 9 7 7 6 6 7 10 56 6 6 5 6 6 5 5 5 6 5 5 5 6 5 4 5 6 5 5 6 6 5 5 5 6 5 5 5 6 5 5 5 6 5 5 6 6 5 5 5 5 5 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 4 5 6 5 5 5 6 5 5 6 5 5 5 6 5 5 5 6 6 4 5 6 6 5 5 6 6 6 10 7 6 6 6 8 10 8 20 25 17 100 77 26 33 31 15 11 8 5 6 6 5 5 6 6 5 5 6 6 5 5 6 7 6 9 22 32 28 27 16 7 6 6 6 6 6 5 6 6 5 5 6 5 5 5 6 5 5 5 6 5 5 5 6 5 4 5 6 5 5 5 6 5 4 5 6 5 4 5 6 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 4 5 6 5 4 5 6 5 4 5 6; 1HNMR: 78 77 dd 1H J 21 32 \| 76 75 ddd 1H J 22 36 79 \| 75 75 dd 1H J 17 63 \| 74 73 dd 1H J 78 101 \| 71 71 dq 1H J 9 79 \| 69 68 d 1H J 16 \| 66 65 dd 1H J 24 96 \| 65 65 s 1H \| 47 47 d 2H J 9 \| 42 42 s 2H \| 38 38 d 7H J 33	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCCCC=Nn1c(C(=O)OC)c(-c2ccccc2)c2cc(Cl)ccc2c1=O	ir: 3 6 9 13 4 3 3 6 2 4 7 4 5 8 20 4 1 2 35 10 2 0 1 2 3 1 1 5 13 28 7 15 30 12 5 1 3 7 5 38 2 6 4 1 7 12 17 32 4 2 2 2 1 1 5 25 3 3 2 1 2 4 35 2 2 5 7 12 15 17 6 6 16 7 2 4 15 5 2 2 1 1 0 1 1 9 0 2 2 1 1 8 2 1 2 2 3 7 1 1 1 1 2 9 3 2 3 4 16 30 1 9 2 3 0 4 3 3 5 13 8 3 6 17 2 2 1 2 1 2 1 1 2 3 14 20 5 100 21 46 10 20 2 3 13 3 0 2 7 2 2 16 5 18 28 20 5 26 1 1 1 1 4 1 1 0 0 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 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 1 1 1 0 1 1 2 1 1 3 3 2 2 3 1 3 1 3 4 11 12 15 37 45 34 7 13 4 2 2 1 1 1 1 1 0 1 1 1 0 1 1 0 1 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 80 80 d 1H J 88 \| 79 78 d 1H J 25 \| 76 76 dd 1H J 25 89 \| 75 74 m 5H \| 66 66 tt 1H J 9 70 \| 38 38 s 2H \| 22 21 td 2H J 68 88 \| 16 15 ttd 2H J 9 63 87 \| 14 13 h 2H J 68 \| 9 8 t 3H J 70	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cc2c(cc1-c1cc(C=O)ccc1N(C)C)C(C)(C)CCC2(C)C	ir: 8 5 1 5 6 3 3 4 4 3 4 4 4 4 3 8 5 5 16 14 5 2 2 3 3 2 3 4 4 2 3 3 3 2 2 4 4 0 11 7 9 4 3 6 4 2 2 4 3 2 4 8 15 100 11 7 6 22 10 15 9 20 10 6 8 9 11 22 14 40 24 15 14 6 10 8 5 3 6 5 3 4 4 5 4 4 7 11 12 12 7 16 17 8 19 12 8 7 8 5 3 3 5 3 39 15 4 4 7 4 4 6 16 4 5 5 3 12 12 14 2 12 12 10 9 16 8 5 5 6 8 13 22 6 3 3 4 4 4 7 12 4 16 74 41 7 15 3 4 4 5 3 10 34 15 11 19 9 10 3 3 4 22 3 4 3 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 2 2 2 3 3 2 1 2 3 2 2 2 3 2 2 2 2 2 2 3 2 2 2 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 2 2 2 2 3 3 2 2 3 3 2 2 3 2 2 2 3 3 4 9 7 3 2 3 7 6 3 4 4 5 6 15 8 25 21 39 88 80 21 11 4 4 2 4 4 3 2 2 3 2 2 2 3 2 2 2 2 2 2 3 3 2 2 3 2 2 2 2 2 2 2 2 2 2 2 3 2 2 2 2 2 1 2 3 2 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 3 2 1 2 3 2 1; 1HNMR: 80 80 d 1H J 22 \| 76 76 dd 1H J 22 80 \| 71 71 s 1H \| 71 70 d 2H J 80 \| 28 28 s 5H \| 25 25 s 3H \| 19 19 m 5H \| 13 13 s 14H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1[nH]c2ccc(N)c(Br)c2c1S(=O)(=O)N1CCOCC1	ir: 10 8 2 25 30 34 13 31 28 12 4 6 10 6 5 11 35 8 8 4 5 3 2 3 3 3 4 10 4 3 2 4 3 3 14 4 4 2 4 4 4 3 6 4 2 2 2 2 3 9 3 7 24 25 5 9 4 3 4 4 6 2 7 6 5 8 15 6 4 8 14 5 1 12 5 12 4 2 25 7 3 5 4 12 59 23 20 46 2 4 3 3 12 4 6 15 4 3 3 6 3 2 3 3 2 3 6 17 2 3 4 16 2 10 12 16 0 4 3 2 1 2 3 2 1 2 2 2 1 3 12 11 2 2 3 2 2 2 3 6 5 13 11 2 2 6 3 2 3 24 3 1 3 12 35 7 12 100 20 4 5 27 9 1 3 3 2 1 2 3 2 0 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 1 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 3 2 3 2 2 1 1 2 2 1 1 2 2 2 2 3 2 2 2 3 4 2 2 3 3 2 3 7 6 2 4 10 7 4 4 3 2 2 2 2 2 1 2 2 2 2 1 1 3 24 98 5 2 0 3 3 12 20 17 9 10 11 60 5 3 2 2 2 1 1 2 2 1 1 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 3 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; 1HNMR: 73 73 d 1H J 70 \| 72 72 d 1H J 70 \| 44 43 q 2H J 64 \| 43 42 s 2H \| 37 36 m 4H \| 32 31 dd 4H J 54 62 \| 14 13 t 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc([C@H]2C[C@H](N)C[C@@H](c3ccccc3)O2)cc1	ir: 5 4 3 2 5 2 4 5 2 3 2 2 11 3 5 3 2 9 4 4 3 3 3 3 3 4 5 3 2 3 4 22 3 3 2 2 3 3 5 3 39 19 4 4 3 3 1 1 2 8 5 1 2 5 10 29 46 25 12 4 4 2 2 2 2 3 3 6 5 6 4 4 3 21 13 22 7 7 5 6 4 2 28 0 2 2 1 2 4 8 2 2 2 1 2 1 1 2 3 2 1 2 1 1 1 1 1 3 2 1 2 3 1 2 4 10 17 7 8 6 7 9 12 5 5 5 7 3 5 6 13 12 14 12 6 21 46 14 2 4 2 2 7 93 10 5 3 2 4 3 7 3 7 2 2 1 1 1 1 1 1 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 2 1 1 1 1 1 1 1 2 2 2 1 2 3 1 1 2 3 1 3 4 8 16 29 100 44 11 3 0 3 3 3 1 2 3 2 2 6 17 20 11 4 4 3 3 6 25 38 5 2 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 78 78 m 2H \| 74 73 m 7H \| 49 48 m 1H \| 48 47 m 1H \| 39 39 s 2H \| 31 29 m 1H \| 28 28 d 2H J 68 \| 22 21 ddd 2H J 40 67 151 \| 20 19 ddd 2H J 39 68 151	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(O)c1ccc(CCc2ccccc2)cc1Nc1ccc(F)cc1F	ir: 0 0 1 0 1 1 0 1 1 1 1 0 0 2 1 1 0 1 1 1 2 2 2 7 1 2 3 2 1 4 4 5 10 1 2 2 1 1 1 4 8 1 2 3 1 0 1 0 1 0 1 3 1 0 4 3 9 1 1 1 0 0 0 0 0 1 3 5 1 2 2 5 1 1 1 1 1 1 9 8 1 1 1 1 0 1 1 1 1 1 0 0 0 0 0 0 0 1 1 1 0 1 1 1 0 1 0 0 0 0 0 0 1 5 7 1 1 2 0 0 1 1 0 1 1 1 1 1 1 2 0 16 0 0 1 3 0 0 0 1 1 0 2 1 1 1 1 1 3 12 1 2 4 1 1 1 1 3 7 1 0 1 4 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 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 1 1 2 2 6 11 1 0 0 1 1 0 0 2 100 4 1 0 1 0 0 1 0 0 1 1 1 2 5 12 5 1 1 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 88 87 d 1H J 29 \| 78 78 d 1H J 80 \| 73 71 m 6H \| 71 71 dt 1H J 9 20 \| 71 70 td 1H J 27 121 \| 70 69 m 2H \| 29 28 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cc(Br)c2cnccc2c1	ir: 4 2 1 3 7 5 2 4 4 2 0 3 4 2 1 17 16 9 8 8 7 3 2 4 4 15 36 21 7 4 10 5 3 1 1 3 3 0 1 3 6 4 1 3 2 0 2 4 2 1 3 8 3 1 4 4 2 0 4 4 2 0 3 4 9 18 16 17 24 6 4 4 2 7 17 21 6 2 3 3 1 1 3 3 1 1 3 4 6 2 3 3 1 1 3 3 2 2 9 21 6 8 4 2 1 3 7 9 3 4 3 2 4 7 100 25 1 3 5 2 1 2 4 2 1 3 4 2 1 3 4 8 3 3 3 1 1 3 3 1 1 3 3 4 2 3 3 1 1 3 2 1 3 4 5 2 4 8 3 1 2 4 2 1 2 4 14 18 6 5 2 0 2 3 2 1 2 3 2 1 2 3 1 0 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 0 1 3 2 0 2 3 2 0 2 3 2 0 2 3 2 0 2 3 1 0 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 5 4 3 5 20 38 4 3 3 2 0 2 3 1 1 2 3 2 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 1; 1HNMR: 94 94 t 1H J 9 \| 87 86 dd 1H J 15 46 \| 76 76 dd 1H J 22 44 \| 74 74 t 1H J 22 \| 73 73 d 1H J 21 \| 38 38 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1COc2ccc(C3=NN(Cc4ccccc4)CC3c3ccccc3)cc2N1	ir: 1 1 3 2 7 12 4 12 0 2 2 3 4 6 45 4 1 5 6 1 1 5 7 4 1 4 5 4 7 20 82 68 41 8 7 6 5 3 7 10 27 100 6 1 2 6 6 3 4 8 11 8 12 33 67 20 3 1 1 0 2 3 1 0 3 6 12 13 19 10 6 2 2 1 2 2 3 2 4 4 1 2 1 6 9 12 3 4 7 7 14 8 10 6 7 3 1 20 8 3 8 25 3 1 2 2 2 1 2 1 2 2 3 6 5 8 7 4 4 11 4 4 5 1 3 1 1 7 8 8 9 26 23 4 9 53 6 1 0 2 2 4 14 11 21 7 6 7 5 5 51 11 43 76 11 5 32 15 2 5 1 1 1 1 9 3 1 2 1 0 0 1 0 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 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 2 5 2 2 2 3 7 7 2 4 12 16 26 64 52 13 6 3 2 5 2 3 2 1 1 1 2 1 2 1 1 1 2 8 16 5 9 22 16 20 9 6 6 4 1 1 1 1 0 0 1 1 0 0 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 1 0 0 1 1 0 0 0 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1; 1HNMR: 98 98 s 1H \| 76 75 dd 1H J 21 83 \| 75 75 d 1H J 22 \| 74 72 m 11H \| 70 70 d 1H J 82 \| 46 46 s 2H \| 46 45 m 2H \| 44 44 d 1H J 119 \| 36 36 dd 1H J 48 101 \| 34 33 dd 1H J 49 102	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2c(=O)n(C)c(C)c(-c3ccccc3)c2c1	ir: 3 2 1 3 7 16 9 3 4 4 3 5 3 3 2 5 3 2 3 2 3 6 4 3 7 4 3 3 3 7 39 36 12 16 8 3 3 6 64 10 6 3 4 5 30 54 8 9 9 0 2 5 3 1 12 17 5 1 3 5 2 1 2 6 2 0 5 13 28 28 9 17 3 3 4 6 5 5 3 4 2 2 3 3 2 3 8 4 3 2 3 2 1 3 3 3 2 2 3 2 1 2 3 2 1 2 3 2 1 2 3 15 3 3 4 2 3 4 7 4 4 8 44 10 21 7 9 5 2 4 8 7 10 11 12 18 6 7 8 4 28 4 3 5 22 7 7 5 5 3 5 12 4 5 6 3 25 28 4 3 3 15 10 4 39 3 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 2 2 2 1 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 3 3 3 2 3 3 3 3 3 3 3 6 5 8 11 18 26 100 44 25 12 9 5 2 3 4 2 2 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1 2 2 2 1; 1HNMR: 80 79 d 1H J 89 \| 74 73 m 5H \| 73 72 m 1H \| 71 71 d 1H J 27 \| 70 69 dd 1H J 27 89 \| 38 38 s 3H \| 36 36 s 3H \| 23 23 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H](c1ccccc1)N1C[C@H](C(O)c2ccccc2)CC1=O	ir: 0 1 0 0 1 0 0 0 1 0 1 1 1 1 1 4 1 0 2 2 2 3 1 1 0 1 1 1 1 1 2 6 2 2 1 1 1 0 2 1 4 6 9 2 2 0 0 0 0 1 1 0 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 1 2 2 1 0 1 1 0 1 1 1 1 1 0 0 0 0 0 1 14 2 4 4 3 3 1 1 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 3 1 1 1 1 0 1 0 1 2 1 2 1 0 1 1 1 1 1 1 1 0 0 1 4 3 13 2 0 0 0 0 0 1 6 3 1 0 2 3 12 4 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 1 1 1 0 0 1 1 0 1 1 2 1 5 11 5 1 1 0 1 2 2 100 5 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 74 72 m 10H \| 48 48 m 1H \| 47 47 q 1H J 70 \| 37 37 m 1H \| 35 34 m 1H \| 31 31 d 1H J 53 \| 26 25 m 2H \| 24 23 m 1H \| 15 14 d 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN1CCN(C(=O)c2cncc(Cl)n2)CC1	ir: 3 4 15 14 5 13 7 15 22 39 55 100 30 20 11 12 4 26 17 4 12 30 42 10 2 4 3 2 2 4 8 3 9 16 4 2 3 5 6 38 40 30 13 5 4 4 3 2 2 3 3 1 2 5 3 2 4 6 3 2 11 26 11 10 7 16 31 14 18 13 5 0 4 5 2 11 15 13 2 95 64 17 8 5 6 10 18 6 6 28 14 4 5 15 37 5 20 33 66 19 6 11 11 4 3 4 4 3 2 3 4 6 33 28 15 7 5 6 8 15 17 17 14 13 15 13 31 14 6 6 7 6 5 6 28 19 8 6 5 6 12 8 3 2 2 2 2 2 2 3 3 12 8 10 6 3 2 2 4 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 2 3 2 4 6 7 4 4 2 3 2 3 4 5 10 11 5 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 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: 89 89 d 1H J 18 \| 85 85 d 1H J 18 \| 36 36 ddd 2H J 35 62 114 \| 35 35 ddd 2H J 35 62 113 \| 32 31 ddd 2H J 35 62 115 \| 29 28 ddd 2H J 35 62 113 \| 25 25 s 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(C)OC(=O)c1ncn2c1C1CCCN1C(=O)c1c(Cl)cccc1-2	ir: 2 1 1 1 0 1 0 0 1 2 2 2 1 1 0 0 2 3 1 1 1 0 0 3 4 3 2 0 0 0 1 1 0 1 0 0 1 1 1 1 6 7 4 5 11 15 12 26 22 3 2 1 2 1 1 1 0 3 1 1 5 14 7 6 4 2 1 1 4 7 1 2 2 1 1 1 3 6 2 1 1 1 1 1 1 3 3 9 5 5 2 2 1 1 2 2 1 1 3 7 7 6 6 3 6 5 16 14 18 16 3 3 2 8 9 10 10 7 8 7 8 12 15 3 5 7 5 8 7 23 27 11 5 2 1 1 1 5 5 3 14 9 4 2 2 12 3 2 0 1 1 4 2 1 0 0 0 0 2 2 1 14 25 0 1 1 8 3 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 1 1 0 0 1 1 1 1 2 1 3 2 4 3 6 4 3 3 6 4 6 11 2 8 100 79 27 16 16 9 18 10 3 1 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 81 81 s 1H \| 76 74 m 3H \| 49 49 t 1H J 52 \| 38 38 ddd 1H J 28 46 120 \| 37 36 ddd 1H J 30 47 119 \| 25 24 m 1H \| 22 21 m 2H \| 20 19 m 1H \| 16 16 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H]1C[C@@H](NC(=O)C2(c3ccc4c(c3)OC(F)(F)O4)CC2)C[C@@H](c2ccc(C(=O)O)cc2)O1	ir: 9 12 2 5 7 5 7 7 7 4 5 6 5 15 23 8 14 28 14 14 2 74 31 26 9 16 11 11 10 6 4 7 10 22 11 6 28 25 25 14 8 6 5 5 11 17 11 5 3 1 9 18 14 16 26 28 25 1 3 2 2 2 2 2 3 2 5 15 42 12 7 6 5 2 18 14 46 34 38 20 7 7 4 1 2 7 9 3 8 10 6 3 6 10 4 19 13 15 39 68 14 5 3 3 2 2 10 10 8 6 3 6 7 11 15 51 17 6 2 5 4 10 10 11 10 7 24 13 3 4 5 7 8 12 4 1 2 3 4 2 7 4 24 84 28 22 10 29 11 12 37 19 23 21 12 2 1 2 2 5 2 1 4 1 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 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 1 0 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 4 2 4 1 3 4 3 9 8 18 13 27 52 61 72 31 14 6 9 3 4 4 58 100 4 4 2 0 1 3 2 1 5 6 5 9 9 32 17 31 4 3 2 2 1 1 1 1 1 1 1 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 88 88 s 1H \| 79 79 m 2H \| 73 73 m 3H \| 71 70 d 1H J 76 \| 70 69 m 2H \| 48 47 dddd 1H J 22 34 49 68 \| 39 37 m 2H \| 23 23 dt 1H J 41 146 \| 21 19 m 2H \| 18 17 dt 1H J 68 138 \| 16 15 m 2H \| 14 13 m 2H \| 11 11 d 3H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1nc(NC2CNCCC2c2cccc(F)c2)c2cccc(C(N)=O)c2n1	ir: 2 4 4 3 1 5 7 12 19 22 9 6 7 5 9 6 7 7 3 7 5 7 7 8 8 17 22 11 8 6 5 4 7 9 10 15 25 7 5 7 9 7 6 6 5 13 49 19 3 4 3 7 6 4 6 5 24 8 4 1 2 8 3 0 2 4 3 1 3 13 4 6 31 11 4 1 4 4 4 7 4 4 2 2 2 3 4 3 3 4 2 3 3 3 1 2 4 3 1 2 4 2 1 3 4 2 1 2 8 4 3 2 6 5 4 9 11 36 15 11 6 8 12 17 6 4 3 4 9 4 6 3 5 62 6 5 6 3 3 14 34 20 4 6 17 7 50 11 5 2 6 10 15 100 6 7 5 12 24 5 38 7 3 3 6 11 2 3 2 0 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 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 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 3 2 2 3 3 3 5 4 3 2 7 7 5 50 21 10 4 3 3 3 2 1 3 3 2 1 3 3 3 3 7 29 11 46 8 7 5 24 19 10 19 5 5 5 44 8 3 2 2 2 2 2 1 1 2 1 1 1 2 1 1 1 2 2 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 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2; 1HNMR: 83 83 dd 1H J 12 100 \| 82 82 s 2H \| 81 81 dd 1H J 11 86 \| 75 74 dd 1H J 86 99 \| 73 73 td 1H J 50 78 \| 71 71 m 1H \| 70 70 dddd 1H J 11 20 77 99 \| 69 69 dtd 1H J 7 21 122 \| 67 66 d 1H J 71 \| 43 42 tt 1H J 32 71 \| 33 32 ddd 1H J 31 49 128 \| 32 31 dddd 1H J 26 37 55 134 \| 30 29 m 2H \| 29 28 dddd 1H J 26 38 53 134 \| 26 25 tt 1H J 38 49 \| 25 25 s 2H \| 22 21 dtd 1H J 27 55 145 \| 19 18 dtd 1H J 26 53 145	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc(CCNC(=O)C2CCCCC2)c1	ir: 6 3 4 6 6 4 2 3 3 3 4 3 4 2 1 4 5 4 5 22 16 23 29 23 10 7 4 5 12 11 27 23 30 57 100 25 31 16 6 12 7 5 5 8 4 1 11 78 6 5 4 2 4 5 5 6 3 3 4 10 4 1 3 9 16 14 26 41 21 11 9 5 6 5 9 5 4 4 6 6 3 4 3 3 5 1 1 2 2 10 14 4 5 2 4 4 2 4 8 10 3 3 2 4 6 4 11 8 9 8 20 33 24 19 20 5 6 6 9 3 12 17 10 8 1 8 9 30 11 14 12 17 6 13 5 1 2 5 3 6 35 29 6 17 58 91 32 51 25 13 9 4 12 8 12 51 12 4 2 1 4 8 5 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 2 2 1 0 1 2 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 2 2 1 1 1 2 1 0 1 2 1 1 1 2 1 1 2 2 0 1 2 2 2 2 4 4 7 4 10 4 3 5 5 9 14 16 30 25 4 18 56 25 12 5 2 2 2 3 2 2 2 3 3 2 2 2 2 2 3 5 5 14 18 64 45 41 25 8 6 2 2 2 2 2 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 2 1 0 1 1 1 0 1 1 1 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 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0; 1HNMR: 72 72 t 1H J 76 \| 69 68 ddq 1H J 9 20 77 \| 68 67 m 2H \| 67 67 t 1H J 50 \| 38 38 s 2H \| 34 33 q 2H J 55 \| 28 27 tt 2H J 9 57 \| 24 23 m 1H \| 19 18 m 2H \| 17 15 m 2H \| 16 16 s 2H \| 15 14 dddd 4H J 24 43 55 93	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)c1c(C(F)(F)F)nc(C(F)(F)F)c(C(=O)OC)c1S(=O)CC	ir: 4 4 11 9 2 4 7 11 15 6 3 4 5 4 4 2 2 1 2 7 2 4 9 16 3 0 0 1 1 0 0 2 2 1 1 3 4 2 2 3 3 2 2 5 8 4 4 3 2 2 2 3 1 1 2 1 1 1 1 2 2 1 1 2 2 4 4 2 2 1 2 2 4 1 3 3 1 1 1 2 1 9 18 3 1 1 3 3 8 100 4 3 2 2 3 22 4 2 26 17 2 2 2 1 2 3 24 12 10 7 3 3 3 4 7 6 5 6 5 6 3 1 2 1 1 2 4 3 2 6 2 1 0 1 1 1 1 1 2 3 9 47 4 6 1 2 2 0 0 2 3 19 6 60 4 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 1 1 2 2 2 1 1 2 4 2 1 1 2 2 2 2 11 17 5 5 2 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 0 0 1 1 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: 44 43 q 2H J 64 \| 39 38 s 2H \| 33 32 q 2H J 79 \| 16 15 t 3H J 79 \| 14 14 t 3H J 64	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
N#Cc1cccc(Cn2cc(-c3ccncc3)c(-c3ccc(F)cc3)n2)c1	ir: 2 1 1 1 2 1 1 3 4 1 5 6 2 1 1 2 2 1 1 2 4 2 4 5 2 1 5 2 6 2 9 3 4 1 1 4 12 7 2 1 1 1 1 2 3 1 8 24 7 18 10 17 15 6 24 47 4 4 3 3 1 1 4 1 1 1 2 4 15 15 38 23 4 2 1 2 1 3 4 2 1 1 4 10 5 3 6 10 23 3 4 3 17 3 4 3 2 2 4 6 6 3 4 2 1 1 1 1 4 3 1 1 1 2 2 3 2 3 16 11 3 3 5 3 2 2 14 20 27 5 3 1 2 2 3 1 2 1 1 4 45 4 3 1 1 2 2 1 13 14 21 1 7 2 11 18 3 2 2 4 2 2 2 1 1 1 1 2 2 7 1 0 1 2 1 4 1 2 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 2 1 1 1 2 1 1 1 2 2 2 2 3 4 4 6 8 15 54 100 59 31 18 12 6 2 4 3 2 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 86 86 m 2H \| 79 79 tt 1H J 9 20 \| 77 77 m 3H \| 76 75 t 1H J 63 \| 75 75 m 1H \| 75 75 m 2H \| 74 74 d 1H J 10 \| 72 71 m 2H \| 54 53 q 2H J 9	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1ccc(-c2ccc3cc(OC)ccc3c2C)cc1	ir: 5 5 8 9 9 14 12 11 5 7 10 6 4 4 14 9 9 10 6 4 6 5 10 11 4 3 3 3 3 4 6 7 4 2 3 4 5 3 3 3 3 2 3 3 3 3 3 4 3 2 3 4 8 38 32 44 53 21 8 0 3 5 3 2 4 10 4 7 22 17 11 4 5 4 3 6 4 5 4 6 3 3 3 3 3 3 3 5 4 3 3 4 3 4 5 6 5 12 7 5 4 5 3 3 2 3 4 5 10 13 10 3 3 3 18 35 21 6 7 6 6 4 2 6 20 7 4 6 4 3 2 3 5 7 5 4 4 2 2 8 17 13 19 30 19 20 3 7 19 47 37 3 4 6 14 2 6 14 30 4 4 4 3 3 3 3 3 2 11 3 3 3 3 3 3 3 3 2 3 3 2 2 3 3 2 2 3 3 3 3 3 3 3 2 3 3 3 3 3 3 3 3 3 3 2 2 3 3 2 2 3 3 2 2 3 3 2 3 3 3 2 2 3 2 2 3 3 3 2 3 3 3 2 3 3 3 2 3 3 2 2 3 3 3 2 3 3 2 3 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 5 4 3 3 3 3 3 3 3 4 3 4 5 10 11 30 49 100 25 18 12 5 5 5 5 3 3 3 3 2 3 3 2 2 3 3 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 3 2 2 3 3 2 2 3 3 2 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 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; 1HNMR: 80 80 m 2H \| 79 79 d 1H J 80 \| 79 78 d 1H J 82 \| 77 77 dd 1H J 21 79 \| 76 75 m 2H \| 72 72 t 1H J 23 \| 70 69 dd 1H J 24 82 \| 39 39 s 3H \| 38 38 s 3H \| 31 30 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C(Nc1cnc([C@H](O)CO)cn1)[C@H](CC1CCCC1)N1Cc2c(cccc2C(F)(F)F)C1=O	ir: 5 10 3 4 11 9 12 13 20 7 5 13 8 14 7 5 12 10 7 2 3 3 3 1 0 1 2 1 3 3 3 6 3 2 5 3 3 6 6 39 12 19 9 4 3 4 8 1 11 6 2 1 2 3 2 2 3 3 2 1 2 2 1 0 1 2 1 0 3 5 7 54 9 4 3 2 1 1 1 0 2 2 1 0 4 12 11 100 21 13 8 6 6 11 11 5 2 4 7 8 23 5 3 1 2 1 1 5 3 4 6 2 2 3 12 13 6 2 2 2 3 1 2 3 7 5 3 5 2 10 10 2 6 4 8 1 2 4 8 2 3 4 3 1 1 3 10 21 8 14 27 7 7 7 3 1 1 2 8 2 3 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 0 0 0 1 1 0 0 1 1 0 1 1 1 1 1 2 1 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 3 2 2 2 2 2 3 5 2 7 20 11 6 32 5 3 3 2 7 14 37 92 77 44 10 1 3 1 1 1 1 1 1 3 4 5 4 19 40 15 5 3 1 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 1 0 1 1 1 1 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; 1HNMR: 86 86 s 1H \| 83 83 s 1H \| 79 78 dd 1H J 11 79 \| 76 76 dp 1H J 13 108 \| 74 73 dd 1H J 79 108 \| 51 51 m 1H \| 48 47 t 1H J 75 \| 46 45 d 1H J 150 \| 45 44 m 2H \| 42 41 m 2H \| 39 38 ddd 1H J 52 64 136 \| 20 19 ddd 1H J 69 77 134 \| 18 17 m 2H \| 16 15 m 4H \| 15 14 m 2H \| 14 13 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CSCCCC(O)CCSC	ir: 9 4 6 5 7 3 0 3 4 2 1 4 5 3 1 3 3 4 3 3 3 2 1 2 3 1 1 4 5 1 3 5 7 1 6 4 2 2 2 5 6 5 7 7 4 0 2 3 2 1 2 3 4 1 2 5 2 1 4 6 3 0 2 8 2 5 2 5 3 5 6 8 5 3 4 4 3 4 4 6 6 1 12 31 27 19 39 100 65 48 16 7 7 6 8 4 6 5 4 5 3 4 5 4 5 9 12 12 3 11 12 10 11 8 10 11 7 11 15 9 6 7 5 3 3 3 4 2 1 4 4 3 1 3 3 1 3 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 1 1 3 2 1 1 2 1 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 2 1 0 1 2 1 0 2 2 1 0 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 3 2 2 4 3 2 3 7 6 7 11 14 6 6 6 6 7 6 7 14 19 15 8 8 4 3 6 7 10 20 54 71 20 18 9 5 4 3 4 4 3 2 5 3 2 3 3 3 2 2 3 3 2 5 4 5 3 2 3 2 1 1 2 2 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 0; 1HNMR: 38 37 h 1H J 56 \| 31 31 d 1H J 53 \| 27 26 dt 1H J 64 134 \| 26 25 m 3H \| 21 21 d 6H J 101 \| 18 16 m 3H \| 16 15 m 1H \| 15 14 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(O)CCCCCn1c(=O)c2c(ncn2C)n(C)c1=O	ir: 14 19 6 17 23 13 3 8 4 4 10 5 7 3 6 7 10 8 1 9 7 16 19 4 4 3 1 4 3 2 1 3 3 3 6 20 14 10 17 15 33 35 7 9 6 6 5 10 4 6 6 8 12 4 7 6 5 3 9 8 10 2 6 13 27 4 8 13 10 27 7 6 6 1 6 8 4 2 7 9 1 3 10 7 3 6 12 27 30 16 6 5 5 4 5 9 46 10 6 9 4 10 10 37 100 22 59 21 56 37 15 17 16 17 35 34 12 18 35 78 39 27 24 28 13 31 93 24 8 17 11 10 9 11 8 3 4 4 5 3 1 4 5 2 3 7 21 5 7 8 26 77 7 4 3 1 2 3 2 1 2 4 2 1 2 3 2 1 2 3 2 0 2 3 2 0 2 3 2 0 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 3 2 1 1 3 2 0 1 3 2 1 1 3 2 1 2 3 2 0 1 3 2 0 2 3 2 0 2 3 2 0 2 3 2 1 2 4 2 1 3 3 2 1 3 3 1 1 3 3 1 1 3 3 1 2 3 3 2 2 5 3 1 2 8 10 14 17 12 25 21 32 17 13 14 14 20 18 9 24 61 69 77 25 20 49 61 25 9 5 2 16 24 5 5 4 3 1 2 3 4 2 1 2 3 2 2 3 3 1 1 3 3 1 1 3 2 1 1 2 2 1 1 2 2 1 1 2 2 0 1 3 2 0 1 3 2 0 2 3 1 0 2 3 1 0 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 2 0; 1HNMR: 75 75 d 1H J 9 \| 40 40 d 3H J 7 \| 38 37 m 3H \| 35 34 s 2H \| 26 25 d 1H J 53 \| 17 16 p 2H J 67 \| 16 15 m 1H \| 15 12 m 6H \| 11 11 d 3H J 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)(P(C1CCCCC1)C1CCCCC1)P(C1CCCCC1)C1CCCCC1	ir: 4 4 12 5 3 8 3 3 4 3 2 2 2 1 1 1 1 3 5 2 2 3 3 2 7 1 1 1 0 0 1 1 1 1 1 2 1 1 9 3 3 7 2 1 4 7 23 3 3 2 2 8 13 8 10 9 10 5 2 3 2 2 4 6 2 0 1 1 2 2 2 2 1 2 2 2 2 2 1 1 1 0 1 1 1 0 2 2 11 13 13 26 20 13 5 4 5 3 1 1 2 4 2 2 3 13 8 5 11 20 69 64 92 46 14 17 18 10 7 7 12 6 8 14 12 7 8 7 8 12 18 10 4 10 4 4 1 2 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 0 0 0 1 0 0 0 0 1 1 0 0 1 0 0 1 1 0 0 1 1 0 1 1 1 0 1 1 1 0 1 1 2 1 1 2 2 2 3 6 9 12 21 13 18 18 10 13 7 10 15 100 45 19 17 12 3 5 2 0 1 2 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 17 15 m 14H \| 15 14 m 7H \| 15 14 m 6H \| 14 13 m 15H \| 14 13 m 1H \| 14 13 m 2H \| 11 11 s 5H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)[C@@H]1CCS(=O)(=O)N1c1ccc(C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)cn1	ir: 18 12 10 21 20 16 19 11 22 14 14 22 17 9 18 13 11 7 6 10 12 6 6 9 10 7 7 17 23 13 5 10 10 11 12 13 17 44 39 79 44 23 20 18 15 5 8 13 9 4 9 15 12 12 27 33 32 35 14 25 9 45 33 32 9 11 8 18 23 17 25 49 19 7 8 10 10 8 12 11 10 22 24 36 15 21 37 27 25 76 21 24 7 9 10 13 8 10 19 100 52 11 17 14 11 13 18 18 9 11 20 31 9 7 19 12 9 14 17 14 0 27 21 33 27 18 16 9 8 9 13 20 28 30 60 17 26 15 27 37 9 11 11 55 6 25 21 24 38 13 20 10 34 21 11 4 5 10 7 4 9 66 11 2 5 10 6 2 5 9 6 2 6 9 5 2 6 9 5 2 6 9 5 3 6 8 5 3 7 8 5 3 7 8 4 4 7 7 4 4 8 7 4 4 8 7 4 4 8 7 3 5 8 6 3 5 8 6 3 5 8 6 3 5 9 6 2 6 9 6 3 6 9 5 3 6 8 5 3 6 8 5 4 6 8 5 4 7 8 5 4 7 7 4 4 7 7 4 4 7 7 4 5 7 7 4 5 8 7 4 7 9 7 8 11 19 14 10 9 12 14 10 14 22 58 12 45 61 38 11 15 14 8 8 7 9 5 4 7 8 5 3 7 8 5 4 7 8 4 4 7 7 4 4 7 7 4 4 7 7 4 4 7 7 4 5 8 6 3 5 8 6 3 5 8 6 3 5 8 6 3 5 8 5 3 6 8 5 3 6 8 5 3 6 8 5 3 6 7 5 4 6 7 5 4 7 7 4 4 7 7 4 4 7 7 4 4 7 6 4 5 7 6 4 5 7 6 4 5 8 6 3 5 8 6 3 5 8 6 3; 1HNMR: 87 87 d 1H J 20 \| 79 79 m 2H \| 79 78 dd 1H J 19 82 \| 77 76 m 2H \| 72 71 d 1H J 80 \| 42 41 qdt 1H J 15 31 86 \| 39 38 ddd 2H J 57 84 123 \| 35 34 m 3H \| 34 33 m 1H \| 32 32 p 1H J 59 \| 23 22 m 1H \| 22 22 m 1H \| 22 21 m 1H \| 21 19 m 4H \| 10 9 dd 3H J 15 66 \| 9 9 dd 3H J 15 66	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)CCNCc1ccc(-c2cc3ncnc(Nc4ccc5[nH]ccc5c4)c3s2)cc1	ir: 6 4 3 3 17 4 3 2 15 9 6 3 4 3 4 3 2 2 12 10 7 60 54 8 2 9 12 5 2 1 1 1 3 2 2 0 2 10 41 57 10 9 5 8 8 4 10 22 32 15 10 12 5 6 48 17 13 15 3 5 28 14 6 10 4 5 4 4 5 6 6 2 2 0 1 1 1 1 2 1 1 0 0 0 1 0 1 2 2 4 3 13 6 4 3 2 3 5 12 5 5 4 3 12 15 5 4 7 2 2 5 6 14 62 13 6 2 3 9 17 4 5 8 3 4 9 7 3 4 11 12 7 5 12 23 8 4 3 4 12 25 33 47 16 100 18 1 7 35 41 27 4 13 9 10 43 25 30 43 4 1 1 1 2 4 57 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 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 3 3 4 9 10 21 30 51 13 57 8 2 2 2 1 1 1 3 2 1 1 1 3 10 47 76 9 16 9 30 64 49 15 4 2 2 1 1 2 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; 1HNMR: 96 95 s 1H \| 87 87 d 1H J 66 \| 86 85 s 1H \| 78 77 m 2H \| 77 76 t 1H J 21 \| 75 75 s 1H \| 74 74 dd 1H J 22 71 \| 74 73 dt 2H J 9 79 \| 73 73 d 1H J 71 \| 72 72 dd 1H J 32 67 \| 63 63 m 1H \| 39 39 dt 2H J 9 55 \| 36 36 s 3H \| 32 32 p 1H J 54 \| 30 29 q 2H J 54 \| 26 25 t 2H J 56	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
NC1CCN(CCn2c(=O)cnc3cc(F)c(F)cc32)CC1	ir: 4 1 1 9 10 5 13 2 0 1 1 1 4 4 2 3 0 1 0 1 0 1 1 0 1 1 3 3 1 3 2 1 1 1 2 2 0 1 1 1 1 1 1 2 4 2 1 2 1 0 1 1 1 4 8 12 10 13 21 29 9 11 4 3 7 12 11 10 7 8 4 1 3 2 4 5 11 13 2 2 19 13 4 3 2 3 7 12 1 0 1 1 0 2 1 2 6 15 11 5 2 2 2 2 3 1 1 3 1 1 1 1 2 1 1 0 0 1 1 1 1 8 1 2 5 5 9 6 3 5 14 7 11 5 11 36 38 5 8 10 7 1 1 1 0 0 0 1 1 0 0 1 4 1 8 11 1 1 1 1 0 0 0 0 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 2 1 1 1 1 2 1 2 3 2 2 1 11 8 3 1 0 0 1 0 1 1 1 2 2 5 22 17 10 3 5 6 5 15 74 100 12 6 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 s 1H \| 74 74 dd 1H J 43 121 \| 73 73 dd 1H J 43 121 \| 42 41 t 2H J 60 \| 31 30 tt 1H J 38 55 \| 30 29 t 2H J 60 \| 29 28 ddd 2H J 55 82 125 \| 28 27 ddd 2H J 55 82 125 \| 19 18 dddd 2H J 39 56 82 136 \| 17 16 m 4H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)c1cnccc1-c1ccccc1C	ir: 5 4 4 4 13 13 19 6 7 6 2 4 10 3 1 3 8 6 4 8 5 2 1 3 3 2 1 5 5 1 3 3 3 1 7 14 22 37 6 6 8 29 46 58 13 7 8 4 3 1 2 3 2 1 3 10 7 1 8 6 2 0 2 4 2 1 3 5 2 1 5 9 18 100 21 9 6 4 3 2 13 4 4 8 2 5 15 6 2 13 9 3 2 2 2 3 2 3 4 2 3 6 4 2 2 2 7 23 9 3 4 3 14 12 37 6 3 4 5 4 3 6 12 3 2 3 3 2 2 3 3 2 2 8 9 3 5 32 4 8 31 25 5 3 2 11 10 26 6 11 87 2 3 9 16 40 5 4 7 3 15 37 7 0 2 4 2 0 2 4 2 0 2 3 2 0 2 3 2 1 2 3 2 1 2 3 1 1 2 3 2 1 2 3 1 1 2 3 1 1 3 3 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 1 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 3 3 1 1 3 2 1 4 3 2 2 2 3 2 1 2 4 3 6 4 15 11 20 24 66 25 12 3 5 5 1 3 3 3 1 3 3 2 1 2 3 1 1 2 3 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 3 2 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 2 2 1 2 3 2 1 2 3 2 1; 1HNMR: 91 91 d 1H J 13 \| 87 86 dd 1H J 14 47 \| 78 78 dd 1H J 12 76 \| 77 77 d 1H J 47 \| 74 74 m 2H \| 73 72 td 1H J 13 75 \| 39 39 s 2H \| 25 24 d 3H J 7	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1cccc(C)c1NN	ir: 2 1 1 1 1 1 1 1 2 1 2 6 2 1 5 11 5 19 9 5 5 5 9 15 39 48 15 12 11 10 4 9 6 1 6 4 15 17 7 4 2 4 5 7 12 28 5 11 8 14 23 32 22 27 9 4 5 5 2 2 1 1 2 4 2 1 1 1 2 1 3 2 1 0 1 2 4 3 1 3 3 2 5 3 1 4 6 8 5 2 1 1 4 3 1 1 1 2 2 10 4 1 2 1 0 1 1 3 4 2 2 1 1 1 1 1 1 1 1 1 2 1 1 2 2 2 2 2 2 6 26 13 12 5 7 5 13 24 37 61 48 11 2 5 3 11 26 10 3 5 18 13 5 2 1 0 1 2 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 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 1 1 1 1 1 1 1 2 3 3 2 3 32 18 3 1 2 1 0 1 2 1 1 2 2 2 22 35 14 3 7 5 3 4 4 26 31 100 30 13 2 3 2 2 2 3 2 1 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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: 70 70 dd 2H J 9 75 \| 70 69 dd 1H J 70 84 \| 62 62 d 2H J 37 \| 56 55 t 1H J 37 \| 22 22 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COC(=O)C(C)NC(=O)Nc1ccc(C=NO)cc1	ir: 5 5 5 15 11 6 9 4 4 5 4 4 3 2 2 20 21 14 3 3 1 3 2 4 7 8 9 7 2 1 1 1 2 1 2 1 2 2 2 1 6 11 26 60 13 3 3 4 5 1 2 2 3 4 15 24 12 4 2 2 1 0 2 4 1 1 1 1 1 9 19 9 8 4 3 27 13 1 2 3 1 11 5 3 0 0 2 1 2 2 2 2 0 1 2 3 2 2 4 10 2 2 10 32 15 7 1 1 2 6 15 8 1 1 2 2 0 2 3 3 5 17 26 18 9 7 11 9 4 2 2 1 0 1 1 0 0 1 2 2 3 4 3 14 17 8 10 7 15 25 12 12 28 16 8 4 5 2 1 1 1 1 1 4 8 4 1 0 1 1 0 0 1 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 1 1 1 1 1 1 1 2 1 0 1 1 0 1 1 1 0 0 1 1 1 1 1 1 0 0 1 1 1 1 1 1 0 1 1 1 1 1 2 3 4 4 3 8 4 14 20 12 5 3 3 3 5 4 100 50 6 1 1 1 1 2 1 3 2 2 1 2 5 8 55 39 43 13 6 1 1 1 1 1 0 1 1 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 1 0 1 1 0 0 1 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0; 1HNMR: 91 91 s 1H \| 82 82 s 1H \| 81 81 s 1H \| 76 75 m 5H \| 66 65 d 1H J 86 \| 46 45 dq 1H J 61 84 \| 37 37 s 2H \| 13 12 d 3H J 61	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1ccc2c(c1)Oc1sc(C)cc1C(=O)N2	ir: 0 5 1 2 1 2 3 1 1 1 2 1 5 2 1 1 1 2 1 1 2 1 7 1 1 3 1 0 1 7 13 11 1 2 1 1 1 2 2 1 1 2 2 2 6 43 44 9 4 2 1 1 2 3 30 10 2 1 1 6 2 2 1 2 7 6 15 7 8 3 1 0 3 2 9 7 4 2 1 1 1 1 1 1 1 1 2 23 2 2 18 2 3 4 1 1 1 1 0 11 7 5 3 4 0 1 0 0 1 1 1 1 1 1 3 6 5 3 1 2 1 2 1 1 1 2 4 3 3 1 3 16 21 1 0 1 1 1 0 1 6 4 1 1 8 0 0 1 1 1 11 6 4 8 4 6 34 7 100 5 1 1 0 6 1 0 1 1 1 0 1 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 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 0 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 1 1 1 1 1 1 2 1 2 6 5 5 14 49 23 7 10 2 1 2 1 1 2 1 1 1 1 1 1 1 1 2 3 2 2 7 20 31 11 3 2 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 1 0 0 1 1 0 0 1 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; 1HNMR: 74 73 d 1H J 87 \| 73 73 s 1H \| 67 67 dd 1H J 23 87 \| 65 65 d 1H J 24 \| 38 38 s 3H \| 24 24 s 3H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CN(C)C1(CC#N)CC1	ir: 2 7 13 9 4 19 25 21 25 34 4 11 9 12 8 7 5 7 27 32 24 7 12 10 7 7 6 4 5 7 6 4 4 6 6 6 6 8 8 21 34 33 28 35 26 8 8 3 6 23 17 7 6 13 14 11 10 29 42 25 18 9 8 6 6 9 11 10 15 11 6 5 6 9 11 9 8 12 11 8 9 6 33 52 20 10 6 5 15 14 24 30 32 17 11 11 10 8 4 4 7 5 2 4 6 5 2 5 10 6 3 9 8 5 4 5 10 8 5 6 7 6 5 11 11 8 5 7 8 5 30 20 45 19 17 9 8 5 4 6 8 4 4 7 6 4 5 6 7 5 8 27 24 22 12 9 7 5 8 13 23 9 7 7 5 2 4 7 5 2 5 8 4 1 5 8 4 0 8 20 6 7 5 5 5 4 5 5 4 3 5 5 4 3 5 5 4 3 5 5 4 4 5 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 4 3 4 6 4 3 4 6 4 3 4 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 6 4 3 5 5 4 4 5 5 3 4 5 5 4 4 6 5 3 4 6 6 5 5 9 7 4 8 7 9 4 15 53 28 20 16 15 6 3 9 46 100 40 15 13 15 17 6 7 5 4 5 5 5 4 6 6 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 3 4 5 5 3 4 6 5 3 4 6 5 3 4 6 5 3 4 6 4 3 4 6 4 3 4 6 4 3 5 6 4 3 5 5 4 3 5 5 4 3 5 5 4 4 5 5 4 4 5 5 4 4 5 5 4 4 5 5 3 4 5 5 3 4 5 5 3 4 6 5 3 4 6 4 3 4 6; 1HNMR: 27 27 s 2H \| 23 23 s 6H \| 15 15 dd 2H J 73 91 \| 13 12 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC1(C)CC(C)(C)CC(O)(c2ccccc2NC(=O)C(C)(C)C)C1	ir: 6 10 1 5 4 4 2 4 8 9 5 7 7 3 3 3 6 4 5 15 7 3 2 3 3 2 3 4 4 7 2 3 2 4 2 4 6 5 4 6 8 13 39 16 13 93 51 18 11 27 7 5 4 2 3 3 5 10 3 6 6 28 48 5 5 16 21 7 4 1 3 4 5 6 16 6 9 85 39 7 4 3 6 9 11 14 22 14 16 13 20 19 6 5 3 14 19 8 11 6 9 6 7 10 10 10 3 6 3 7 6 8 10 17 21 10 6 5 7 15 17 12 4 7 3 4 5 6 5 10 6 5 4 8 4 7 31 24 21 21 10 29 3 12 4 5 35 82 7 27 49 48 22 63 10 6 26 100 10 1 4 14 4 1 2 3 2 0 1 3 1 0 1 3 2 0 1 2 1 1 1 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 2 1 1 2 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 3 2 2 2 2 3 2 7 4 2 2 5 6 3 2 2 6 10 10 47 40 24 18 69 49 43 15 7 3 6 6 31 12 3 3 3 2 1 4 4 3 3 6 12 17 26 42 38 57 28 12 5 3 5 3 3 2 1 3 2 1 1 2 2 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 1 1 1 2 1 1 1 2 1 1; 1HNMR: 90 90 s 1H \| 79 78 m 1H \| 74 73 m 1H \| 72 72 m 3H \| 33 32 s 1H \| 21 20 d 2H J 137 \| 18 18 d 2H J 135 \| 15 14 s 2H \| 12 12 s 9H \| 11 11 s 6H \| 10 10 s 6H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
COc1cccc(CCNC(N)=O)c1	ir: 1 1 1 1 1 2 2 2 2 2 2 3 5 5 12 12 9 3 3 4 4 2 1 5 3 1 3 2 2 2 4 6 3 6 12 9 31 30 20 15 4 4 2 4 3 3 2 12 4 2 2 2 1 1 3 1 1 1 2 2 1 1 1 1 2 1 3 5 4 3 3 6 3 2 2 1 3 5 2 1 2 3 1 1 1 1 1 1 2 3 3 3 1 1 1 1 1 1 2 3 1 1 1 1 1 1 1 1 1 1 3 1 1 4 2 1 1 1 1 1 2 3 3 4 2 2 3 2 1 1 1 1 1 1 1 1 1 1 2 1 15 9 3 3 3 7 7 4 17 36 3 2 6 2 7 12 1 18 100 63 28 4 3 6 2 0 1 2 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 2 1 2 1 2 1 2 7 6 2 8 36 11 3 2 1 1 1 1 1 1 1 1 1 2 1 1 2 26 5 2 2 1 6 7 23 13 24 9 4 10 42 86 13 6 3 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1; 1HNMR: 72 72 t 1H J 76 \| 69 68 dtd 1H J 8 20 77 \| 68 67 m 2H \| 60 59 t 1H J 44 \| 52 52 s 2H \| 38 38 s 2H \| 34 33 td 2H J 44 52 \| 28 27 tt 2H J 9 53	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
O=C1CCN(c2ccccc2)N1	ir: 3 4 10 7 8 39 3 7 7 5 4 9 11 5 3 3 4 3 4 9 18 8 14 16 6 3 3 6 7 14 37 4 4 2 4 4 5 3 4 5 18 59 42 0 3 6 4 2 2 3 3 5 3 3 3 3 2 2 2 2 7 2 3 4 3 11 3 6 22 7 32 4 5 2 3 3 2 2 5 2 2 2 2 2 3 2 2 2 2 2 2 2 2 3 4 3 2 3 4 4 2 4 6 16 5 3 2 3 3 3 3 3 7 11 13 9 4 4 5 3 3 3 2 5 4 4 9 5 4 2 3 4 5 12 4 6 8 2 2 3 3 3 3 7 67 10 8 2 3 5 4 3 5 8 19 100 10 4 3 2 2 5 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 4 6 8 3 3 4 3 2 3 3 25 3 15 85 23 10 3 2 3 3 2 2 3 3 2 2 2 3 3 2 3 3 2 2 5 9 37 18 16 8 5 5 4 5 4 2 2 2 3 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2; 1HNMR: 87 87 s 1H \| 73 73 m 2H \| 71 70 m 2H \| 70 69 tt 1H J 14 79 \| 38 37 m 2H \| 26 25 m 2H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@H](O)CNC(=O)c1ccc2c(c1)nc(Nc1nc3ccc(OC(F)(F)F)cc3s1)n2C	ir: 6 6 2 4 4 4 6 4 3 4 3 5 4 4 3 8 7 4 4 6 4 5 1 6 17 30 5 9 4 5 2 3 3 2 2 12 8 1 3 6 32 39 6 1 3 2 4 5 9 1 1 2 2 2 6 13 6 3 3 5 3 4 1 2 1 1 11 2 3 4 3 1 0 1 3 3 1 1 1 1 1 4 2 1 1 1 2 1 4 1 5 9 6 17 12 8 9 27 14 42 21 20 7 2 2 2 3 1 2 8 16 8 2 2 1 2 3 2 1 1 15 5 3 1 1 8 3 2 1 1 6 11 1 1 1 0 0 1 1 1 1 2 17 8 57 100 11 2 4 3 15 1 20 41 32 7 6 2 4 4 6 2 1 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 1 1 1 1 1 2 1 1 1 4 3 2 9 23 30 8 5 11 13 8 6 1 1 2 1 1 1 2 2 2 1 6 8 5 11 3 15 24 18 41 13 5 7 3 1 2 1 1 1 0 0 1 0 0 0 0 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0; 1HNMR: 80 80 d 1H J 23 \| 78 78 m 2H \| 76 75 d 1H J 68 \| 75 75 t 1H J 66 \| 73 73 m 2H \| 66 66 s 1H \| 40 39 m 1H \| 38 37 s 2H \| 35 34 ddd 1H J 41 66 130 \| 33 32 ddd 1H J 42 67 132 \| 27 27 d 1H J 49 \| 12 11 d 3H J 62	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
c1ccc2c3c([nH]c2c1)C(c1ccc2c(c1)CCC2)NCC3	ir: 2 2 1 1 0 1 0 2 2 2 0 0 0 0 1 1 1 1 0 0 1 0 0 1 1 2 13 3 2 5 3 1 1 4 4 1 1 1 2 1 1 11 21 4 1 1 5 2 4 4 3 9 14 22 0 1 1 6 4 4 1 1 4 21 13 4 1 3 3 4 6 1 1 1 3 1 0 1 1 2 0 0 0 2 2 1 0 4 0 1 1 5 2 4 1 1 8 4 1 3 9 2 1 1 1 7 2 3 8 22 2 2 2 11 11 3 6 2 5 3 0 3 5 3 0 1 4 6 7 9 5 8 5 1 1 0 1 2 1 0 2 2 1 1 2 3 1 2 1 1 3 0 1 5 4 1 0 1 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 2 2 1 1 1 2 1 1 2 9 9 6 16 11 3 2 1 1 0 0 1 1 1 1 1 0 1 1 1 1 3 6 100 36 1 2 2 2 7 19 5 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 0 0 0 0 0 0 0 0; 1HNMR: 81 81 s 1H \| 76 76 dd 1H J 25 69 \| 72 72 m 2H \| 72 71 m 2H \| 71 70 td 1H J 21 70 \| 69 69 q 1H J 9 \| 53 53 dd 1H J 8 52 \| 38 37 dt 1H J 39 55 \| 34 33 dddd 1H J 29 40 57 134 \| 32 31 dddd 1H J 29 38 55 132 \| 30 29 ddd 1H J 29 56 158 \| 29 28 m 5H \| 21 20 p 2H J 63	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CC(C)=CCC/C(C)=C/COc1ccc(C(=O)NCC(=O)Nc2ccccn2)cc1	ir: 2 2 2 5 0 2 1 2 1 2 2 1 4 4 4 4 6 3 3 3 3 4 4 2 2 2 3 1 6 11 8 9 5 8 7 3 9 6 26 74 100 53 15 3 17 10 9 12 4 6 3 1 6 2 8 8 3 5 1 1 3 5 3 1 18 2 4 2 3 6 10 2 3 2 2 2 2 2 4 2 3 10 4 2 2 1 1 1 3 1 1 2 10 2 1 1 3 8 3 4 1 1 0 1 1 1 1 1 2 1 1 2 2 4 2 3 5 4 2 4 6 6 5 4 4 3 2 2 1 1 1 2 3 2 3 3 10 6 4 7 21 22 7 13 31 8 7 15 9 10 12 10 4 3 9 2 4 3 40 7 4 2 5 8 1 1 1 1 1 0 1 1 1 0 1 1 0 0 0 1 0 0 1 1 0 0 1 1 1 1 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 1 0 0 1 0 0 1 1 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 1 0 1 1 0 0 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 1 2 3 7 8 4 14 71 25 16 7 2 2 2 1 1 1 2 1 0 1 1 1 1 1 3 2 5 3 2 8 17 26 10 4 3 2 2 1 0 1 1 0 0 1 1 0 0 1 1 0 0 1 1 0 1 1 0 0 0 1 0 0 0 1 0 0 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; 1HNMR: 95 94 s 1H \| 82 82 m 2H \| 80 79 dd 1H J 14 77 \| 78 78 td 1H J 17 74 \| 77 77 m 2H \| 71 70 ddd 1H J 15 44 71 \| 70 69 m 2H \| 54 54 ddt 1H J 13 46 60 \| 51 50 ddtq 1H J 14 27 68 86 \| 46 45 dh 2H J 10 40 \| 40 40 d 2H J 60 \| 22 20 m 4H \| 17 16 dq 6H J 12 159 \| 16 16 h 3H J 11	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
Cc1ccccc1-c1ccc2c(c1)C(O)=C(C(=O)NCC(=O)OC(C)(C)C)C(=O)C2(C)C	ir: 10 11 7 7 2 8 10 10 11 11 6 9 11 8 8 5 5 5 8 7 4 8 6 2 3 6 8 5 3 20 14 15 6 12 13 13 41 18 12 18 11 16 100 16 9 10 5 4 4 6 5 5 7 7 13 32 56 19 11 2 11 17 10 6 18 9 4 4 12 7 3 4 13 10 5 6 26 11 5 7 5 5 9 18 22 5 5 44 8 15 10 7 18 11 13 6 7 7 4 3 4 6 12 19 7 8 4 6 13 10 2 3 6 4 3 6 10 14 7 10 8 9 6 11 14 21 6 8 8 14 11 23 34 8 3 10 17 9 26 7 15 11 15 21 29 6 7 9 35 35 13 21 11 4 34 10 4 10 5 53 17 0 4 7 5 18 4 6 3 1 3 5 3 1 3 5 3 1 3 5 3 1 4 4 3 2 3 4 2 2 3 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 4 2 2 4 3 1 3 4 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 5 3 1 3 4 3 2 3 4 2 2 3 4 2 2 3 4 2 2 4 4 2 2 4 4 2 3 4 4 2 3 5 5 2 3 5 5 4 5 6 4 4 5 6 4 3 5 7 13 26 23 10 13 73 32 10 8 5 4 4 4 9 81 7 6 4 4 4 3 3 4 4 4 3 5 10 27 32 24 30 11 5 7 7 5 5 4 4 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 2 2 3 4 2 2 3 3 2 2 3 3 2 2 3 3 2 2 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4 3 2 3 4; 1HNMR: 86 86 t 1H J 58 \| 82 81 d 1H J 22 \| 77 77 ddd 2H J 16 33 82 \| 75 75 d 1H J 83 \| 74 72 m 4H \| 40 40 d 2H J 59 \| 24 24 d 3H J 7 \| 16 15 s 6H \| 14 14 s 8H	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
C[C@@H](NCc1ccc(Cl)c(NCc2ccccn2)c1)c1ccccc1	ir: 1 1 6 19 12 17 10 9 29 11 32 20 6 9 3 4 4 2 11 6 1 5 3 4 2 6 9 5 5 7 5 11 12 12 6 11 9 22 23 13 25 16 69 54 27 3 2 4 1 0 2 6 14 9 15 9 8 6 4 13 22 7 3 11 9 8 24 11 14 8 15 5 3 7 1 1 1 2 2 2 2 5 6 1 1 1 0 1 5 17 7 1 1 2 2 13 4 3 3 3 2 7 4 1 0 1 4 1 1 5 15 11 30 32 8 9 4 10 17 8 4 6 4 9 3 8 1 3 7 5 11 26 10 21 30 38 12 8 17 3 1 3 2 13 8 13 14 3 3 6 5 8 6 7 24 6 7 15 1 2 1 1 15 5 1 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 1 1 1 0 0 1 0 0 0 0 0 0 1 1 1 1 1 1 2 1 1 1 2 2 2 2 5 6 19 41 100 60 14 5 4 1 2 2 3 1 1 1 1 1 3 1 1 2 10 12 46 12 3 10 19 36 19 8 3 4 2 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; 1HNMR: 84 84 dd 1H J 16 41 \| 78 77 td 1H J 16 75 \| 74 74 dq 1H J 10 77 \| 73 73 s 5H \| 73 72 m 2H \| 71 70 ddt 1H J 9 19 83 \| 67 67 dt 1H J 9 20 \| 53 52 t 1H J 54 \| 47 46 dd 2H J 8 54 \| 43 42 ddt 1H J 50 56 70 \| 40 40 ddt 1H J 9 58 136 \| 39 38 ddt 1H J 9 58 137 \| 28 28 dt 1H J 58 70 \| 15 15 d 3H J 53	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.
CCOC(=O)C1=C(COCCNCC(N)=O)NC(C)=C(C(=O)OC)C1c1ccccc1Cl	ir: 6 6 3 4 3 6 6 3 7 7 78 33 9 4 2 4 5 14 20 15 8 2 4 5 5 6 3 16 12 16 16 23 9 33 8 8 5 6 7 6 5 20 19 9 12 9 9 8 7 4 4 5 2 7 5 3 6 3 3 7 2 3 2 2 4 3 5 2 7 7 5 5 3 4 20 2 4 6 3 3 3 2 2 1 2 2 2 3 2 2 2 3 6 3 3 3 5 2 2 2 4 3 4 1 2 3 17 8 7 4 24 7 22 33 3 13 6 4 2 4 5 2 2 3 2 3 6 4 6 2 1 8 5 6 5 4 32 2 2 9 7 8 3 3 2 7 9 4 26 6 3 4 6 61 9 7 18 51 15 15 7 3 2 3 1 0 2 3 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 0 1 2 1 0 1 2 1 1 1 2 1 1 1 2 1 0 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 2 2 1 3 3 2 2 3 2 2 2 3 4 5 6 6 4 23 11 3 2 2 1 2 1 1 1 2 1 1 2 4 3 3 10 15 33 100 13 7 18 38 8 11 4 3 6 9 49 6 4 2 2 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; 1HNMR: 78 77 s 1H \| 76 75 td 1H J 15 78 \| 75 75 dd 1H J 14 78 \| 74 73 ddd 1H J 7 14 76 \| 73 72 td 1H J 13 78 \| 68 67 s 2H \| 53 53 dq 1H J 10 19 \| 48 47 m 2H \| 41 40 q 2H J 71 \| 36 36 d 2H J 43 \| 36 36 s 3H \| 36 35 m 1H \| 35 34 d 2H J 55 \| 30 29 dt 2H J 42 55 \| 23 23 d 3H J 11 \| 12 12 t 3H J 71	You are an expert in IR and 1H NMR analysis. Generate the corresponding SMILES structure from the given spectra.

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