RDKit 3D 57 59 0 0 0 0 0 0 0 0999 V2000 8.2192 1.9562 -2.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1446 0.4400 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5520 -0.0761 -1.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1987 -0.2577 -0.9637 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2809 0.1580 -1.9245 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 -0.0973 -1.7497 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4448 -0.7648 -0.6122 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3649 -1.1752 0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7302 -0.9191 0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -0.9827 -0.5234 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3413 -1.5363 0.5274 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8159 -1.9285 1.5912 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1623 -1.6747 0.2431 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3945 -2.7439 -0.8199 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8135 -0.0459 -0.2976 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4193 -0.1229 0.3999 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0902 -1.2016 0.1752 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3816 -1.3152 0.7003 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1132 -2.4807 0.4624 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4196 -2.6398 0.9622 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9805 -1.5945 1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2599 -0.4263 1.9608 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9654 -0.2992 1.4493 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1729 0.9195 1.6781 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6634 1.8552 2.3107 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8844 0.9495 1.1411 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1356 2.1948 1.3745 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5881 3.3275 0.4326 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0013 4.6643 0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1433 3.0610 -0.8988 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2047 -3.9082 0.6921 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3818 -3.9684 1.1679 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6273 -4.8114 0.0110 O 0 0 0 0 0 1 0 0 0 0 0 0 8.7525 2.2826 -1.2391 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7401 2.3468 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2221 2.4049 -2.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6551 0.0744 -3.0992 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1672 0.0458 -2.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5852 0.6899 -2.8187 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2222 0.2386 -2.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0581 -1.7004 1.2481 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4346 -1.2481 0.9341 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4912 -0.6109 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6419 -1.9642 1.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0517 -2.4753 -1.7845 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4594 -2.9355 -0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0635 -3.6903 -0.5103 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6713 -3.2851 -0.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9915 -1.7061 2.1063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7102 0.3716 2.5439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3089 2.4965 2.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 2.0280 1.2779 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6808 3.3998 0.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9062 4.6372 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3113 5.4593 0.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3246 4.9325 1.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 3.6525 -1.4914 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 7 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 20 31 1 0 31 32 2 0 31 33 1 0 9 4 1 0 26 16 1 0 23 18 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 5 39 1 0 6 40 1 0 8 41 1 0 9 42 1 0 10 43 1 0 13 44 1 1 14 45 1 0 14 46 1 0 14 47 1 0 19 48 1 0 21 49 1 0 22 50 1 0 27 51 1 0 27 52 1 0 28 53 1 6 29 54 1 0 29 55 1 0 29 56 1 0 30 57 1 0 M CHG 1 33 -1 M END