RDKit 3D 144147 0 0 0 0 0 0 0 0999 V2000 12.6761 -5.2003 0.9815 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1119 -3.9817 1.7174 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1532 -3.3027 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5002 -2.0791 1.3434 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5295 -1.0275 1.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3573 -0.5755 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7331 0.0130 -0.5799 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9813 1.2730 -0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7549 1.3695 0.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1057 2.7596 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7216 3.0318 -1.3196 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7011 2.0423 -1.8733 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5559 2.1408 -1.0941 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5909 1.2780 -1.5824 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5544 2.1184 -2.0461 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8537 2.6143 -0.9169 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1984 3.9014 -1.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8297 1.5006 -0.6205 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0449 1.8399 0.4552 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7333 2.0781 -0.0071 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4695 3.4130 0.3572 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6682 3.9131 -0.2425 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3268 4.7184 -1.4754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6062 2.7834 -0.5858 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8740 3.3733 -0.8317 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4271 3.2767 -2.0972 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7539 3.8828 -2.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8264 2.6787 -3.0224 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6516 1.7478 0.5114 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5976 0.7949 0.2061 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6015 0.6486 1.1539 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5654 -0.6532 1.6266 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5254 -1.5539 0.5756 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9445 -2.9059 1.1699 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3743 -1.1941 -0.6010 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6527 -0.6534 -1.6684 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5899 -1.2909 -2.8792 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8089 -0.6729 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1934 -2.3793 -3.0298 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5175 -0.3151 -0.1612 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3824 -1.1051 0.5756 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6216 -1.2629 -0.0012 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.5490 -0.5915 0.7914 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7682 -1.2083 2.0197 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.6417 -0.3024 2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5419 -2.4860 1.6805 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.1423 -3.0495 2.8015 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5255 -3.1183 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2573 -3.7067 4.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2541 -2.6784 1.9301 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5375 -3.3871 0.9939 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.1736 -4.5461 0.5832 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0779 -2.6505 -0.2554 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.2393 -2.5554 -1.0849 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3398 -3.0975 -2.3431 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6228 -2.9124 -3.0845 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3689 -3.7176 -2.8166 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9841 0.8655 0.5864 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8870 1.3193 1.5822 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4365 2.5828 1.5157 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3792 3.0205 2.5831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1097 3.3053 0.5494 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2552 1.1355 0.6150 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1910 -0.0628 -0.0839 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5972 0.2204 -0.4718 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2819 -0.3155 0.7978 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 0.3571 -0.5113 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6198 -0.9218 -0.7831 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3524 -5.7687 1.6578 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2744 -4.7960 0.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8305 -5.8026 0.5971 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9406 -3.3521 2.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5982 -4.3853 2.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6081 -3.0627 -0.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3421 -4.0447 0.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8598 -1.6432 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9357 -2.3347 2.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2323 -1.5089 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0525 -0.2325 2.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0989 0.1802 1.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0859 -1.3914 0.2668 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0358 -0.8087 -1.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4925 0.0830 -1.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7315 2.0842 -0.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7658 1.6157 -1.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0227 0.5902 0.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0247 1.3779 1.3546 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2067 2.7529 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8503 3.5108 0.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 3.1825 -1.9995 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1867 4.0234 -1.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1345 1.0036 -1.8254 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5434 2.3227 -2.9242 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0073 0.7338 -2.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5296 2.7328 -0.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3497 3.7149 -1.9672 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9939 4.5288 -1.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8924 4.4643 -0.4077 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2364 1.4483 -1.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7147 1.9235 -1.0883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1908 4.5882 0.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6341 5.2479 -1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1053 5.5004 -1.6019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2492 4.0637 -2.3438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2192 2.2929 -1.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7196 4.3582 -3.3856 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0077 4.6164 -1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5388 3.0955 -2.4219 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8863 2.2312 1.5025 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3623 1.3883 1.9515 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4483 -1.6357 0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9576 -2.8009 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2707 -3.0979 2.0359 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -3.7118 0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8241 -2.1687 -0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4441 0.1469 -4.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8995 -0.2275 -3.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5125 -1.3906 -4.7644 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9848 0.0508 -1.1056 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6765 -0.7093 -0.9906 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8129 -1.4285 2.5314 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0459 -0.8939 3.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0600 0.5402 3.2379 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5065 -0.0081 2.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3186 -2.1455 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5877 -3.9841 4.8513 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8651 -4.5694 3.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0205 -2.9299 4.3255 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7165 -3.5597 1.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3162 -4.6030 -0.3918 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3502 -3.2399 -0.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3915 -2.4644 -2.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0105 -3.9403 -3.3379 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4892 -2.4048 -4.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8739 1.6961 -0.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4388 2.2994 3.4054 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3878 3.2587 2.1907 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9716 4.0122 2.9367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0496 0.9791 1.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2219 -0.7908 0.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2572 -0.5561 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 0.1868 1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5131 0.6568 0.4726 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0419 -1.6279 -0.3697 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 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 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 26 28 2 0 24 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 35 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 48 50 2 0 46 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 2 0 40 58 1 0 58 59 1 0 59 60 1 0 60 61 1 0 60 62 2 0 29 63 1 0 63 64 1 0 18 65 1 0 65 66 1 0 65 67 1 0 67 68 1 0 67 14 1 0 63 20 1 0 58 31 1 0 53 42 1 0 1 69 1 0 1 70 1 0 1 71 1 0 2 72 1 0 2 73 1 0 3 74 1 0 3 75 1 0 4 76 1 0 4 77 1 0 5 78 1 0 5 79 1 0 6 80 1 0 6 81 1 0 7 82 1 0 7 83 1 0 8 84 1 0 8 85 1 0 9 86 1 0 9 87 1 0 10 88 1 0 10 89 1 0 11 90 1 0 11 91 1 0 12 92 1 0 12 93 1 0 14 94 1 6 16 95 1 1 17 96 1 0 17 97 1 0 17 98 1 0 18 99 1 6 20100 1 6 22101 1 1 23102 1 0 23103 1 0 23104 1 0 24105 1 6 27106 1 0 27107 1 0 27108 1 0 29109 1 1 31110 1 1 33111 1 6 34112 1 0 34113 1 0 34114 1 0 35115 1 6 38116 1 0 38117 1 0 38118 1 0 40119 1 6 42120 1 6 44121 1 1 45122 1 0 45123 1 0 45124 1 0 46125 1 6 49126 1 0 49127 1 0 49128 1 0 51129 1 1 52130 1 0 53131 1 6 56132 1 0 56133 1 0 56134 1 0 58135 1 6 61136 1 0 61137 1 0 61138 1 0 63139 1 1 64140 1 0 65141 1 6 66142 1 0 67143 1 1 68144 1 0 M END