RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 -0.5299 -2.2481 -2.5406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -1.4017 -1.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9464 -0.6437 -1.7674 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5616 0.0907 -0.6411 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1329 -0.8416 0.2525 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4981 -0.8696 0.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0821 -1.8626 1.4138 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -0.0836 -0.1117 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6869 1.0074 0.1244 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8515 2.4713 -0.2293 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1199 3.0477 0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3637 3.0464 0.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4906 4.1992 0.9196 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3363 2.0558 0.3304 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7846 0.8531 -0.1512 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2592 -0.3830 0.5516 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3114 -1.4847 -0.4866 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3172 -2.7472 0.0981 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6459 -1.2025 -1.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4353 -0.5376 -0.3136 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -0.3274 0.9490 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0984 0.9302 1.6647 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -1.4317 1.7601 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4203 -2.8604 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1288 -2.3293 -3.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7304 0.0811 -2.6096 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6954 -1.3463 -2.2135 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4005 0.6893 -1.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5181 -1.2788 2.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3409 -2.5990 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9404 -2.3878 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8318 0.9331 1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7636 2.6512 -1.3176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 2.2676 0.8343 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9036 3.8714 1.0665 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7065 3.4672 -0.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9313 0.7911 -1.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5878 -0.6531 1.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0107 -3.2780 -0.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8956 -1.5073 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4626 -0.2117 -0.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5437 1.6980 1.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3122 1.3258 2.3218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9402 0.6351 2.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2561 -1.5961 2.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 11 10 1 0 10 9 1 0 9 15 1 0 15 14 1 0 14 12 1 0 12 13 2 0 15 16 1 0 16 21 1 0 21 22 1 0 21 23 1 1 21 20 1 0 20 19 2 0 19 17 1 0 17 18 1 1 17 2 1 0 2 1 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 2 0 12 10 1 0 17 16 1 0 4 9 1 0 11 34 1 0 11 35 1 0 11 36 1 0 10 33 1 6 9 32 1 1 15 37 1 6 16 38 1 1 22 42 1 0 22 43 1 0 22 44 1 0 23 45 1 0 20 41 1 0 19 40 1 0 18 39 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 6 7 29 1 0 7 30 1 0 7 31 1 0 M END