RDKit 3D 56 58 0 0 0 0 0 0 0 0999 V2000 3.9339 3.4352 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5559 3.5536 0.7366 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4498 2.8977 -0.6544 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7367 1.4595 -0.6681 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0424 1.0981 -1.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9248 1.9124 -1.2757 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3546 -0.3407 -1.0254 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6287 -0.8011 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8826 -2.1727 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8741 -3.0911 -1.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -2.5951 -0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3362 -1.2246 -0.6852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -0.7838 -0.3403 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8097 0.4823 -0.3427 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1775 0.9759 0.0653 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2853 -0.3804 1.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7443 -0.2312 1.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0993 0.1401 2.6891 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6224 -0.5793 0.5689 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0632 -0.4265 0.6965 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4775 0.5769 -0.3608 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3706 0.4901 -1.7387 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8713 1.6478 -2.4008 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3466 2.5836 -1.5116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1838 2.0697 0.1099 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7836 -1.7909 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2911 -2.8098 1.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3059 -1.6513 0.6612 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1461 -4.5822 -1.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 -4.9514 -1.3568 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1778 -5.3460 -0.7398 O 0 0 0 0 0 1 0 0 0 0 0 0 2.2344 4.9455 0.6209 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7055 3.8732 0.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9628 3.9908 2.3197 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1949 2.3943 1.5854 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8191 3.1157 1.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4522 3.0810 -1.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1238 3.4201 -1.3456 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4203 -0.1058 -1.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8710 -2.5453 -1.6427 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8156 -3.3007 -0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1598 -1.3584 0.7088 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3314 -0.3506 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2383 -0.7464 -0.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2927 -0.0335 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9505 -0.3660 -2.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8802 1.7877 -3.4747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7774 3.5502 -1.7334 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5658 -2.2033 -0.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4467 -2.4442 2.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8273 -3.7594 1.4627 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2256 -3.0242 1.4396 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7935 -2.6290 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7217 -1.0176 -0.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -1.2166 1.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9645 5.3779 0.1436 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 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 20 26 1 0 26 27 1 0 26 28 1 0 10 29 1 0 29 30 2 0 29 31 1 0 2 32 1 0 14 4 1 0 12 7 1 0 25 21 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 1 3 37 1 0 3 38 1 0 8 39 1 0 9 40 1 0 11 41 1 0 16 42 1 0 16 43 1 0 19 44 1 0 20 45 1 1 22 46 1 0 23 47 1 0 24 48 1 0 26 49 1 0 27 50 1 0 27 51 1 0 27 52 1 0 28 53 1 0 28 54 1 0 28 55 1 0 32 56 1 0 M CHG 1 31 -1 M END