RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 0.5045 2.7325 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.8912 -0.9539 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 2.2157 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6375 3.3490 -2.1776 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4609 1.0111 -2.5962 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2339 0.0078 -1.5797 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0949 0.4502 -1.0856 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7144 -0.2604 0.0306 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1017 0.0604 0.0635 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1034 -0.8695 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7361 -2.0434 -0.4195 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5389 -0.5313 -0.1344 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8821 0.9175 0.1767 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5453 -1.5094 -0.2017 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1629 -0.8527 -1.4595 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0649 -0.1166 1.3685 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2309 -0.9351 1.2716 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6090 -1.5543 2.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2687 0.0529 0.7506 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5739 -0.4587 1.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0496 -1.2626 0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1082 -1.3418 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9538 -2.2444 -1.6739 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3903 -0.0144 -0.7176 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4590 1.0161 -1.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2533 3.8007 -0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2665 2.4564 0.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1023 -0.9420 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7976 0.3220 -1.9702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -1.3648 -0.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7735 1.5652 -0.7297 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9618 0.9604 0.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3171 1.2878 1.0319 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6042 -1.2449 0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3054 -2.5838 -0.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6875 -0.6497 2.1149 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1923 0.9023 1.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1476 -1.7307 0.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.9111 3.2768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6992 -1.9720 3.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2648 -2.4435 2.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0816 1.0727 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -0.2286 2.1701 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0012 -1.8008 0.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3491 1.9484 -0.5434 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4757 0.6364 -0.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3885 1.2097 -2.2118 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 16 1 0 16 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 12 10 1 6 12 13 1 0 12 14 1 0 14 15 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 6 24 1 0 24 25 1 6 24 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 19 17 1 0 15 12 1 0 2 7 1 0 22 24 1 0 18 39 1 0 18 40 1 0 18 41 1 0 17 38 1 6 16 36 1 0 16 37 1 0 8 30 1 6 13 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 14 35 1 0 7 29 1 6 6 28 1 6 1 26 1 0 1 27 1 0 25 45 1 0 25 46 1 0 25 47 1 0 19 42 1 6 20 43 1 0 21 44 1 0 M END