RDKit 3D 42 44 0 0 0 0 0 0 0 0999 V2000 2.7229 2.5717 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1854 1.6021 -0.0721 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9866 0.3929 0.5491 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9875 0.4278 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4001 0.6632 1.1743 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1028 1.6349 1.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4777 2.0077 1.3774 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0822 0.8777 0.5752 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1196 0.5126 -0.5159 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8398 -0.3056 -1.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9169 -0.1897 0.0702 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3354 -1.5526 0.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1524 -0.3773 -1.0132 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2122 -1.4338 -1.8347 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4778 -0.6441 -0.3984 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3536 -1.6228 -0.4905 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2497 -2.8575 -1.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4626 -1.2777 0.3887 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4939 -2.0251 0.5345 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2233 -0.0613 1.0106 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8773 3.5392 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 2.8414 1.6196 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7112 2.2898 1.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3204 1.1448 2.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9802 -0.6000 2.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6442 2.2236 2.5607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0811 2.1060 2.3102 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5245 2.9655 0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3016 0.0627 1.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0446 1.2212 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7676 1.4467 -0.9897 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8647 -1.3794 -1.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4349 -0.1012 -2.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9057 0.0514 -1.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4051 -1.6756 0.7017 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0682 -2.3261 -0.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8035 -1.8444 1.4546 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1689 0.5634 -1.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2407 -1.2652 -2.7164 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0478 -3.5586 -1.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2866 -3.3902 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3548 -2.6581 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 1 11 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 2 0 18 20 1 0 15 3 1 0 20 3 1 0 11 5 1 0 1 21 1 0 1 22 1 0 1 23 1 0 4 24 1 0 4 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 8 29 1 0 8 30 1 0 9 31 1 6 10 32 1 0 10 33 1 0 10 34 1 0 12 35 1 0 12 36 1 0 12 37 1 0 13 38 1 6 14 39 1 0 17 40 1 0 17 41 1 0 17 42 1 0 M END