RDKit 3D 131131 0 0 0 0 0 0 0 0999 V2000 -8.9835 -4.8501 -1.8158 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5325 -4.9013 -0.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4029 -4.9416 0.6380 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6360 -6.1876 0.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6312 -3.6506 0.5635 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5342 -3.4641 1.5318 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4084 -4.4412 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2472 -2.0659 1.9197 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8745 -0.9829 1.0494 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7605 -0.5662 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4483 -0.5709 0.8071 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5367 0.5108 -0.0965 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2516 1.7517 0.4835 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4496 2.4256 0.4686 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4425 3.7584 0.8565 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6542 4.3760 0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8969 5.7116 0.3351 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3378 6.7824 -0.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7463 8.1968 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4514 6.5933 -1.1833 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1793 4.4621 0.6270 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2063 4.0608 1.6165 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5916 3.8670 -0.6651 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5447 3.6701 -1.6364 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1547 2.4589 -0.2133 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6931 1.8422 -1.3464 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5021 -1.5532 0.2540 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8789 -2.0584 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -1.1689 0.5512 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0346 -1.2334 -0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1108 -1.7587 -1.5808 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2622 -0.8698 0.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9168 -2.0403 0.7962 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1568 0.0318 -0.3947 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4364 1.3559 -0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2739 0.3975 0.5052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5634 0.2168 0.2423 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -0.3913 -1.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5707 0.5721 1.2704 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6851 -0.3971 2.2964 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8479 1.1661 0.8794 C 0 0 2 0 0 0 0 0 0 0 0 0 5.7407 2.4456 0.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1376 0.5547 0.9404 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5316 -0.6181 0.6019 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7106 -1.6495 0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9838 -0.9852 0.8198 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3915 -2.1281 0.4846 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8712 -0.1095 1.3752 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2196 -0.3165 1.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0374 -0.5089 0.3975 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6855 -1.5601 -0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9988 0.7784 -0.4284 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7317 0.9682 -0.9189 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0628 0.6616 -1.4890 C 0 0 2 0 0 0 0 0 0 0 0 0 14.2836 0.4526 -0.8348 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1147 2.0065 -2.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9416 2.2924 -2.8673 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8602 -5.0183 -2.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5386 -3.8647 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2538 -5.6638 -1.9778 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2411 -4.1041 -0.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0624 -5.8768 -0.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9127 -5.0805 1.6203 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6762 -6.0187 -0.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4239 -6.7648 1.2721 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2776 -6.8321 -0.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4065 -2.8520 0.6683 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1787 -3.6634 -0.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0707 -3.8523 2.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6516 -5.4638 1.8456 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5866 -4.1461 2.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9428 -4.5807 0.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -2.1547 2.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1338 -1.7494 2.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1467 -0.0258 1.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1562 0.0430 -0.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5558 0.1936 0.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1977 -1.3582 -0.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0519 -0.1089 1.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9322 1.5359 1.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6319 3.8130 1.9882 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5985 3.8417 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7053 4.1189 -0.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8629 8.7724 0.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4634 8.1619 0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1622 8.6484 -0.9755 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1361 5.5338 0.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4242 4.6380 1.5073 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 4.4324 -1.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1891 4.0200 -2.4956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2759 2.6645 0.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 1.8235 -2.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5706 -2.5376 0.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0182 -1.9824 -1.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7281 -3.1487 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -1.3964 -1.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -0.7428 1.5946 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5844 -2.7215 -1.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0163 -2.0056 -1.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -0.9969 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0955 -0.3027 1.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3911 -1.9536 1.6576 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4341 -0.3890 -1.3428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0491 1.2742 -1.6679 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2649 1.5841 0.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2373 2.1402 -0.7749 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9698 0.8572 1.4765 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9408 -0.0067 -1.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2269 -0.1171 -1.8947 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9647 -1.4951 -1.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 1.3806 1.8961 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9827 -1.0917 2.1119 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9934 1.8335 1.9574 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6251 3.1163 0.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5905 2.2403 -1.0377 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 3.0465 0.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0216 1.1974 1.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7323 -1.8734 0.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6142 -1.6536 -1.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2633 -2.6388 0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6297 0.5073 2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2945 -1.2728 2.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1064 -0.6708 0.7289 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3407 -1.2828 -1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2696 1.6191 0.2832 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6020 0.6783 -1.8432 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8244 -0.1684 -2.1499 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4634 -0.5248 -0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9543 1.9872 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3663 2.7860 -1.4455 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7136 3.2647 -2.7774 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 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 2 0 15 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 11 27 1 0 27 28 1 0 27 29 1 0 29 30 2 0 30 31 1 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 2 0 44 45 1 0 44 46 1 0 46 47 2 0 46 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 54 56 1 0 56 57 1 0 25 13 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 1 4 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 1 7 70 1 0 7 71 1 0 7 72 1 0 8 73 1 0 8 74 1 0 9 75 1 1 10 76 1 0 10 77 1 0 10 78 1 0 11 79 1 1 13 80 1 1 15 81 1 1 16 82 1 0 16 83 1 0 19 84 1 0 19 85 1 0 19 86 1 0 21 87 1 6 22 88 1 0 23 89 1 6 24 90 1 0 25 91 1 1 26 92 1 0 27 93 1 1 28 94 1 0 28 95 1 0 28 96 1 0 29 97 1 0 31 98 1 0 31 99 1 0 31100 1 0 32101 1 1 33102 1 0 34103 1 6 35104 1 0 35105 1 0 35106 1 0 36107 1 0 38108 1 0 38109 1 0 38110 1 0 39111 1 1 40112 1 0 41113 1 1 42114 1 0 42115 1 0 42116 1 0 43117 1 0 45118 1 0 45119 1 0 45120 1 0 49121 1 0 49122 1 0 50123 1 1 51124 1 0 52125 1 1 53126 1 0 54127 1 6 55128 1 0 56129 1 0 56130 1 0 57131 1 0 M END