RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 0.3536 -3.4318 -0.3879 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4128 -2.3672 0.4689 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -1.1261 -0.1282 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6904 -0.3701 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -0.7889 0.5466 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1522 -2.2052 0.9857 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7261 0.3575 0.6288 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9379 0.2963 1.0395 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0301 1.4532 0.1967 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 1.0469 -0.2812 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8985 1.1801 -1.6971 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1731 2.5138 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 1.8374 0.1457 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2523 0.9805 1.0487 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4271 1.8229 1.4615 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 2.2377 0.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7339 1.0229 -0.4311 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8462 0.5375 0.2154 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -0.0026 -0.7248 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3263 -1.2193 -1.2888 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7531 -0.2853 0.4036 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4861 -1.0659 1.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3693 -4.3584 0.2599 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 -3.5175 -0.9631 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1709 -3.4574 -1.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3498 -1.2838 -1.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1436 -2.2484 1.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1506 -2.8486 0.1056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4148 -2.4879 1.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2569 2.6609 -3.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1795 2.8155 -1.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4691 3.2302 -1.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8345 2.7586 0.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 2.0731 -0.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3335 0.7294 1.9485 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0716 1.3571 2.2123 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0055 2.7614 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7713 2.9852 -0.3719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1709 2.7684 0.6763 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0982 1.3841 -1.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5478 0.1937 -0.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0488 0.4370 -1.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2605 -0.8808 -1.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7217 -1.7202 -2.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6348 -1.9779 -0.5753 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5825 -2.1283 1.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9414 -0.9906 2.4618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.6789 1.6734 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 2 0 5 6 1 0 5 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 1 0 21 22 1 1 10 11 1 6 11 12 1 0 21 3 1 0 10 4 1 0 21 14 1 0 1 23 1 0 1 24 1 0 1 25 1 0 3 26 1 6 6 27 1 0 6 28 1 0 6 29 1 0 13 33 1 0 13 34 1 0 14 35 1 1 15 36 1 0 15 37 1 0 16 38 1 0 16 39 1 0 17 40 1 6 18 41 1 0 19 42 1 6 20 43 1 0 20 44 1 0 20 45 1 0 22 46 1 0 22 47 1 0 22 48 1 0 12 30 1 0 12 31 1 0 12 32 1 0 M END