RDKit 3D 59 63 0 0 0 0 0 0 0 0999 V2000 8.4601 0.9889 0.0353 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9937 0.6665 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0635 1.7099 0.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6884 1.4514 0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1974 0.1423 0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1339 -0.8987 0.0285 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5235 -0.6561 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4668 -1.8273 0.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7978 -0.1061 0.0074 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8213 0.9450 -0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5306 0.2052 -0.4964 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6823 -1.0801 0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1709 -1.3208 0.2948 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6536 -2.4140 0.5514 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6926 1.0269 -0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 2.2293 0.0894 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8663 0.2955 -0.1694 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 0.7994 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5371 2.0219 0.6478 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8833 1.8481 0.9977 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3332 0.6217 0.7622 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3025 0.0221 0.0941 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5409 -1.2190 -0.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6196 -2.0180 -0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8951 -3.2334 -0.7987 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0997 -3.6375 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0404 -2.8352 -2.3169 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7674 -1.6258 -1.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3949 -4.8944 -2.5676 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.2854 -5.6146 -2.0969 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7314 -5.1564 -3.5811 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.6133 2.9645 1.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3741 4.2914 1.6330 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0919 4.6599 3.0097 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7701 5.2891 0.6529 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9572 3.3465 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0174 0.3267 0.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6432 2.0145 0.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8562 0.8848 -0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4004 2.7436 0.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0221 2.3073 0.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8048 -1.9338 0.0145 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2355 -1.7119 -0.7335 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9439 -2.7679 -0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9438 -1.9149 1.0176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0987 1.6041 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 1.5281 0.7508 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4905 -0.0211 -1.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3416 -0.9776 1.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1659 -1.9150 -0.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8008 -0.7002 -0.3403 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2512 -1.7086 0.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7328 -3.8343 -0.4532 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4363 -3.1235 -3.1754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9944 -0.9932 -2.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4740 3.2905 1.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8909 2.7423 2.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2051 3.2935 1.7564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 3.8785 0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 5 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 11 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 26 29 1 0 29 30 2 0 29 31 1 0 20 32 1 0 32 33 1 0 33 34 2 0 33 35 2 0 33 36 1 0 7 2 1 0 13 9 1 0 22 18 1 0 36 19 1 0 28 23 1 0 1 37 1 0 1 38 1 0 1 39 1 0 3 40 1 0 4 41 1 0 6 42 1 0 8 43 1 0 8 44 1 0 8 45 1 0 10 46 1 0 10 47 1 0 11 48 1 6 12 49 1 0 12 50 1 0 17 51 1 0 24 52 1 0 25 53 1 0 27 54 1 0 28 55 1 0 32 56 1 0 32 57 1 0 36 58 1 0 36 59 1 0 M CHG 2 29 1 31 -1 M END