RDKit 3D 116118 0 0 0 0 0 0 0 0999 V2000 12.3148 -2.9038 -2.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5028 -1.6362 -2.5443 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7012 -1.4590 -3.8132 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5791 -1.8188 -1.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7701 -0.5744 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8118 -0.7148 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6191 -0.9829 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9822 -1.1219 2.5658 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2783 -0.0065 3.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0781 0.6124 2.5839 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9303 -0.3158 2.4074 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -1.5525 2.5039 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6117 0.2125 2.1163 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5217 -0.7102 2.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4585 1.6102 1.9147 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8284 2.1753 3.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6063 1.5847 3.4857 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6931 2.0754 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2876 2.6975 -0.1866 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3031 1.9153 0.5963 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5613 2.4038 -0.5455 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1209 3.8400 -0.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3714 1.6152 -0.8431 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2098 0.5008 -0.2764 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6512 2.0370 -1.7491 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8402 1.3457 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8753 1.1075 -1.1006 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8518 0.3656 -1.5297 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9983 1.5424 0.2057 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0485 2.4689 0.7985 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1321 1.0767 1.0644 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0039 -0.3841 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7751 -0.8007 1.0717 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9377 -1.4011 1.2108 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8812 -2.1059 0.3518 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2312 -3.3774 -0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 -2.5851 1.0834 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6516 -3.2657 2.1572 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4633 -2.5126 0.9556 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4695 -3.1092 0.1070 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.0734 -3.4197 -1.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9494 -3.1196 -1.6844 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8799 -4.0630 -2.1806 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7993 -2.2546 0.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4373 -0.8853 -0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5121 -0.9073 -1.8081 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8262 0.0296 -2.5674 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0632 0.9732 -1.8935 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4192 1.8181 -2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9891 1.0008 -0.4838 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7045 0.0667 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7192 1.7568 -0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6698 1.1007 0.6807 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4288 1.6638 0.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2570 2.8605 -0.0772 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2607 3.5359 -0.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5154 2.9442 -0.6738 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5639 3.6138 -1.3026 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9905 -2.8792 -3.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9531 -3.0387 -1.7926 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6255 -3.7507 -2.8205 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1189 -0.7445 -2.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6893 -1.9342 -3.6977 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2554 -1.9559 -4.6445 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6011 -0.3753 -4.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2901 -1.9414 -0.4706 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9778 -2.7286 -1.3981 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4793 0.2595 -0.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1459 -0.3478 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1910 -1.6284 -0.2163 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2023 0.1823 0.0072 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5251 -0.2950 1.2961 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1239 -1.9961 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2989 -2.0285 2.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8236 -1.4724 3.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 0.8155 3.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 -0.3991 4.2182 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2272 1.2076 1.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7118 1.3889 3.3471 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9892 -0.5886 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8661 -0.6620 2.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -1.7689 1.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4596 2.1020 1.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5291 2.0751 4.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6486 3.2703 3.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5522 1.2232 4.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7589 1.4200 1.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 2.5762 -1.4019 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0075 4.5062 -0.1559 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7497 3.8480 0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3133 4.1849 -0.8083 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 2.9680 -2.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4862 0.3171 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2996 1.7737 -3.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2671 2.0083 1.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6843 3.2186 0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 3.0132 1.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9264 1.5364 2.0303 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9923 -1.8393 2.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1611 -1.4140 -0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9167 -4.2018 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1453 -3.1984 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1958 -3.5188 0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8609 -1.8372 1.7508 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8009 -4.0473 0.5827 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7957 -4.4002 -1.9523 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4753 -2.7224 -0.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1908 -2.4315 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1178 -1.6453 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8936 0.0170 -3.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4601 1.8122 -3.7591 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8014 0.1964 1.4076 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8908 0.2339 1.4062 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2399 3.3227 -0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0939 4.4653 -1.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5118 3.2857 -1.1711 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 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 2 0 41 43 1 0 40 44 1 0 44 45 1 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 48 50 2 0 50 51 1 0 50 52 1 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 56 57 1 0 57 58 1 0 54 31 1 0 51 45 2 0 57 52 2 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 1 3 63 1 0 3 64 1 0 3 65 1 0 4 66 1 0 4 67 1 0 5 68 1 0 5 69 1 0 6 70 1 0 6 71 1 0 7 72 1 0 7 73 1 0 8 74 1 0 8 75 1 0 9 76 1 0 9 77 1 0 10 78 1 0 10 79 1 0 14 80 1 0 14 81 1 0 14 82 1 0 15 83 1 6 16 84 1 0 16 85 1 0 17 86 1 0 20 87 1 0 21 88 1 6 22 89 1 0 22 90 1 0 22 91 1 0 25 92 1 0 26 93 1 0 26 94 1 0 30 95 1 0 30 96 1 0 30 97 1 0 31 98 1 1 34 99 1 0 35100 1 6 36101 1 0 36102 1 0 36103 1 0 39104 1 0 40105 1 1 43106 1 0 44107 1 0 44108 1 0 46109 1 0 47110 1 0 49111 1 0 51112 1 0 53113 1 0 55114 1 0 56115 1 0 58116 1 0 M END