RDKit 3D 55 57 0 0 0 0 0 0 0 0999 V2000 -1.3898 4.6017 2.9424 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1743 3.1315 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8133 2.3682 2.2192 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7777 1.0150 2.4021 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2353 0.4747 3.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4798 0.3144 1.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4157 -1.0365 0.9947 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3172 -1.3478 -0.0937 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9991 -0.2444 -0.5591 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5742 1.1569 0.3137 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9049 -0.1627 -1.5613 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5013 -2.6604 -0.6474 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6511 -3.7296 -1.0785 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5118 -2.0596 1.6393 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.7636 0.6621 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3203 -2.0580 0.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6799 -0.9495 0.5246 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9429 -2.8576 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5494 -4.0709 -0.5376 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1766 -4.8512 -1.5077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2005 -4.4191 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5895 -3.2150 -3.1929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9618 -2.4117 -2.2287 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1517 -0.9053 -2.7675 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6049 0.0867 -3.2651 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 0.2629 -2.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5943 -0.4501 -2.0543 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3276 1.2390 -1.1862 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1365 1.3570 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3028 2.2102 0.9626 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4908 3.0746 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.1067 -1.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9073 5.2380 3.6908 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9905 4.8561 1.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4607 4.8271 2.9198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6199 2.8883 4.2225 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0989 2.9079 3.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1612 0.7606 -1.9021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -0.8811 -2.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1333 -2.8055 2.1475 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8471 -1.6475 2.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5436 -4.4013 0.4963 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6547 -5.7861 -1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6948 -5.0224 -3.5916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6132 -2.9101 -4.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1195 -0.4030 -4.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2711 1.0584 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3733 0.3725 0.4327 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0693 1.8613 -0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6297 1.5725 1.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9147 2.7902 1.6583 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 3.5030 0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1121 3.8980 -0.3633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 2.6172 -2.0689 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 1.4993 -0.8686 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 4 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 9 11 1 0 8 12 1 0 12 13 3 0 7 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 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 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 10 6 1 0 23 18 1 0 32 28 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 11 38 1 0 11 39 1 0 14 40 1 0 14 41 1 0 19 42 1 0 20 43 1 0 21 44 1 0 22 45 1 0 25 46 1 0 25 47 1 0 29 48 1 0 29 49 1 0 30 50 1 0 30 51 1 0 31 52 1 0 31 53 1 0 32 54 1 0 32 55 1 0 M END