RDKit 3D 40 43 0 0 0 0 0 0 0 0999 V2000 3.4845 2.1837 1.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7228 0.9510 0.4278 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6897 0.1195 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3449 0.4342 0.2199 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3449 -0.3920 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6927 -1.5769 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9924 -1.9425 -1.0232 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0134 -1.0752 -0.6009 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3538 -1.3774 -0.7904 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4326 -2.4509 -1.2106 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2955 -2.5140 0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7398 -1.2426 0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6443 -1.2363 1.9341 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6301 0.2284 2.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3074 0.9062 1.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1475 2.3160 0.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5686 2.8272 -0.3747 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1823 1.8440 -1.2699 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5806 1.9312 -1.0612 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7103 0.4632 -1.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0682 -0.0662 0.0077 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3848 2.5300 1.6175 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 2.9744 0.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6894 2.0224 1.8498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1174 1.3544 0.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2658 -2.8736 -1.5108 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5701 -2.2525 -1.2477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -3.4978 -1.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9734 -2.1216 -2.0939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1268 -3.2459 -0.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6157 -2.9718 0.8254 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7218 -1.7347 2.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5538 -1.6847 2.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8495 0.7153 3.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6736 2.9555 1.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4438 3.8579 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0497 2.2466 -2.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9766 1.3441 -1.7552 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9679 0.2691 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5585 -0.2176 -1.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 8 2 0 8 9 1 0 8 7 1 0 7 6 2 0 6 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 18 20 1 0 21 20 1 6 21 5 1 0 5 4 2 0 4 3 1 0 5 6 1 0 21 12 1 0 21 15 1 0 1 22 1 0 1 23 1 0 1 24 1 0 9 27 1 0 7 26 1 0 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 13 32 1 0 13 33 1 0 14 34 1 0 16 35 1 0 17 36 1 0 18 37 1 6 19 38 1 0 20 39 1 0 20 40 1 0 4 25 1 0 M END