RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 -2.2203 -4.4681 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7499 -3.4688 -0.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6353 -2.1300 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9893 -1.7739 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -2.7931 1.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5716 -4.1311 1.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8434 -0.3122 1.1098 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5756 0.3193 0.4695 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6132 0.2967 -1.0076 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5488 1.2053 -1.8418 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4947 2.5531 -1.3215 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3518 0.9135 -3.2424 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0676 0.4544 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4822 -0.7378 -1.9275 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6571 -1.3503 -1.4908 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4261 -0.7564 -0.4872 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0154 0.4481 0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8313 1.0557 -0.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6589 1.0320 1.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9982 1.4125 0.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9638 0.2416 0.9204 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7332 -0.7500 -0.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5085 -1.4672 -0.0488 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1744 0.4263 1.0547 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5672 1.5753 0.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9633 2.5951 -0.3257 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 3.6355 -0.7386 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1112 3.7651 -0.3981 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7658 2.8671 0.3565 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9981 1.7097 0.8409 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4152 0.7549 1.5735 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.3285 -0.1961 1.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3028 -5.5119 -0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2431 -3.7364 -1.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 -1.3692 -1.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9286 -2.5614 2.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1479 -4.9146 1.7297 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6144 -0.3286 2.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2986 -0.2549 0.7991 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4599 1.3447 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6901 -0.6297 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8983 -1.1993 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -2.2941 -1.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 1.9828 0.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2892 2.1654 1.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0448 1.9068 -0.1537 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9913 0.6171 0.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8282 -0.2652 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 -1.4989 -0.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7855 -0.2700 -1.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 2.5487 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2591 4.4187 -1.3492 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6276 4.6416 -0.7862 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8148 2.9868 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3746 0.6981 1.9084 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1441 -0.2351 2.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6421 -1.1678 1.4334 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 2 0 10 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 7 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 6 1 1 0 18 13 1 0 23 16 1 0 32 24 1 0 30 25 1 0 1 33 1 0 2 34 1 0 3 35 1 0 5 36 1 0 6 37 1 0 7 38 1 1 8 39 1 0 8 40 1 0 9 41 1 0 14 42 1 0 15 43 1 0 18 44 1 0 20 45 1 0 20 46 1 0 21 47 1 0 21 48 1 0 22 49 1 0 22 50 1 0 26 51 1 0 27 52 1 0 28 53 1 0 29 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 M CHG 1 31 1 M END