RDKit 3D 97100 0 0 0 0 0 0 0 0999 V2000 -0.6092 0.3222 1.6356 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4782 -0.6330 1.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1262 -1.9709 1.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7104 -0.9315 -0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0836 0.1823 -1.0426 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2671 -0.4193 -2.3218 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0471 1.1869 -1.3042 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1815 0.4838 -1.9333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9178 -0.2618 -2.9344 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.5486 -1.5494 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5297 -0.1531 -2.2137 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7987 0.0965 -1.4971 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0125 -0.0877 -2.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2427 0.0942 -1.4626 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2621 0.4809 -0.1453 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4259 0.6745 0.5468 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7343 0.5283 0.0944 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.4107 1.7349 0.2721 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7204 1.6212 -0.1832 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.3959 2.9742 -0.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6942 2.8809 -0.6638 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4665 0.7786 0.8417 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.7874 0.6874 0.4845 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8559 -0.5921 0.8864 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.3083 -1.1970 2.0814 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3654 -0.5791 0.9287 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.9126 -1.8027 0.4048 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0233 0.6714 0.4779 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8204 0.4891 -0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2713 0.9524 -0.6641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2311 1.0380 -1.4794 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4181 1.6022 0.5433 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6152 2.3097 0.7872 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8027 1.4496 0.7416 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7627 0.0732 0.7232 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9082 -0.6850 0.6725 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1587 -0.0789 0.6375 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2648 -0.8747 0.5858 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6051 -0.5179 0.5366 C 0 0 2 0 0 0 0 0 0 0 0 0 10.1707 -0.9083 -0.7004 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5403 -0.6397 -0.6447 C 0 0 2 0 0 0 0 0 0 0 0 0 12.1027 -0.6965 -2.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9004 -1.9387 -2.5927 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2544 -1.6586 0.2209 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4066 -1.0696 0.7555 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3403 -2.1384 1.3388 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6825 -3.2909 0.9352 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3371 -1.0584 1.7156 C 0 0 1 0 0 0 0 0 0 0 0 0 10.9805 -0.0230 2.4003 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2117 1.2962 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0353 2.0560 0.7073 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2048 1.3640 1.7934 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0133 0.0727 2.6756 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 0.3736 0.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3877 -0.2971 1.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7751 -2.3645 1.4863 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0978 -1.7843 3.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9389 -2.7005 1.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2675 -1.3444 -0.5392 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4275 -1.7706 -0.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3345 -1.3844 -2.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3979 1.8527 -2.1294 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2724 1.8269 -0.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3541 -1.2238 -2.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5966 0.2564 -3.2472 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0002 -0.3919 -3.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1621 -0.0658 -2.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8013 0.2890 -0.9804 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8237 1.1599 -1.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3710 3.4508 0.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8032 3.5861 -0.9465 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9808 3.6274 -1.2489 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2908 1.2467 1.8263 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0031 -0.2403 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2490 -1.1861 0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9910 -1.8886 1.8962 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9481 -0.4776 1.9558 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6721 -2.4369 1.1342 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0615 0.9862 1.5301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 0.6430 0.3425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7043 3.1868 0.1106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5565 2.7287 1.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8091 -0.4169 0.7538 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8859 -1.7759 0.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6758 0.6028 0.5124 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6291 0.3874 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2141 -0.5614 -1.9278 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7421 0.1301 -2.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6112 -1.8067 -3.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5721 -2.5575 -0.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2340 -1.4963 0.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9703 -2.3582 2.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7180 -3.3051 1.2153 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6381 -1.5224 2.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7358 -0.4285 2.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1288 1.8591 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1046 3.1489 0.7212 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 6 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 19 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 15 28 1 0 28 29 2 0 5 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 41 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 46 48 1 0 48 49 1 0 37 50 1 0 50 51 2 0 29 12 1 0 51 34 1 0 26 17 1 0 48 39 1 0 1 52 1 0 1 53 1 0 1 54 1 0 2 55 1 0 3 56 1 0 3 57 1 0 3 58 1 0 4 59 1 0 4 60 1 0 6 61 1 0 7 62 1 0 7 63 1 0 11 64 1 0 11 65 1 0 13 66 1 0 14 67 1 0 17 68 1 6 19 69 1 6 20 70 1 0 20 71 1 0 21 72 1 0 22 73 1 1 23 74 1 0 24 75 1 6 25 76 1 0 26 77 1 1 27 78 1 0 28 79 1 0 29 80 1 0 33 81 1 0 33 82 1 0 35 83 1 0 36 84 1 0 39 85 1 1 41 86 1 1 42 87 1 0 42 88 1 0 43 89 1 0 44 90 1 6 45 91 1 0 46 92 1 1 47 93 1 0 48 94 1 1 49 95 1 0 50 96 1 0 51 97 1 0 M END