RDKit 3D 45 46 0 0 0 0 0 0 0 0999 V2000 3.6316 0.8511 2.6053 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4217 0.3924 2.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6628 -0.8370 1.2827 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5768 -1.4097 0.6996 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9472 -0.6796 -0.2945 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0329 0.1227 0.2923 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -0.1021 0.1032 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8617 1.0831 -0.6334 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7992 0.8127 -2.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6597 -0.1648 -2.5564 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0822 1.4956 -0.1892 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0275 0.5193 -0.0601 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1790 1.1575 0.4716 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5631 -0.5096 0.9060 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7476 -1.7780 0.3113 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1131 -0.3477 1.3182 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8040 -1.5737 1.9407 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8384 0.1171 -1.1812 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4649 1.4848 -1.0994 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2936 0.0678 -0.9082 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8717 1.3558 -0.7902 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 -0.7281 0.2508 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0480 -2.0291 -0.1715 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9302 1.6560 2.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 1.2165 1.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7935 0.1032 2.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0474 -1.6083 2.0202 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4942 -1.4963 -0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4038 -0.9850 -0.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1659 1.9690 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 0.5254 -2.3777 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0481 1.7457 -2.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0128 0.0479 -3.4635 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3726 0.0638 -1.0211 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 0.5391 1.0296 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2103 -0.5056 1.8136 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2228 -1.8993 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0785 0.4967 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3829 -1.6132 2.7439 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6497 -0.1097 -2.2775 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8931 1.9668 -1.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8184 -0.3551 -1.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0517 1.7468 -1.6624 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6853 -0.3164 0.6523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6685 -2.4884 0.4209 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 1 0 6 7 1 0 7 16 1 0 16 17 1 0 16 14 1 0 14 15 1 0 14 12 1 0 12 13 1 0 12 11 1 0 11 8 1 0 8 9 1 0 9 10 1 0 5 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 3 1 0 8 7 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 1 5 28 1 6 7 29 1 6 16 38 1 1 17 39 1 0 14 36 1 1 15 37 1 0 12 34 1 6 13 35 1 0 8 30 1 6 9 31 1 0 9 32 1 0 10 33 1 0 18 40 1 6 19 41 1 0 20 42 1 6 21 43 1 0 22 44 1 1 23 45 1 0 M END