RDKit 3D 107107 0 0 0 0 0 0 0 0999 V2000 10.8860 -0.9730 -0.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6157 -1.7892 -0.3355 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4611 -1.0421 -0.9676 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2391 0.2051 -0.1374 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1287 1.0524 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7536 0.5114 -0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.1786 0.7156 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8848 -0.8338 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 -0.3503 0.5556 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8715 0.6578 -0.0814 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9053 1.8858 0.8498 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4104 0.2563 -0.1514 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6192 1.1713 -0.7587 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 2.3638 -1.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8007 2.6272 -2.4878 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0318 3.6183 -0.5962 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1454 4.5664 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 3.3803 0.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4891 2.3809 1.0825 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1811 1.6719 2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7871 2.0141 0.4501 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0181 2.7548 -0.8455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 2.2458 1.3809 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8299 1.3135 1.7667 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1647 1.1292 2.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5265 0.4762 0.7239 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.6214 1.3641 0.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4676 0.7750 -0.8819 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.4840 1.8713 -1.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3249 -0.3419 -0.3079 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9971 -0.7494 1.2966 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4665 -1.9825 0.8848 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2011 -3.0268 1.0033 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1206 -2.2162 0.3155 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2034 -2.9478 -1.0136 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0002 -2.1595 -2.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8386 -4.3055 -0.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4112 -3.1340 1.2142 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0137 -3.0732 1.4518 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4351 -4.1195 1.8508 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2122 -1.8240 1.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1969 -2.1623 1.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1003 -2.1972 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8841 -3.1799 0.1198 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1801 -1.0979 -0.7783 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0830 -1.4413 -1.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1018 -0.4940 -1.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7754 -0.2440 0.5481 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7034 -1.6524 0.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7654 -2.7771 -0.8125 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3327 -1.9763 0.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6049 -1.7223 -1.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8093 -0.7320 -1.9848 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1884 0.8134 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2690 -0.0286 0.9223 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1068 1.9633 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3743 1.5225 -1.6169 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 1.3623 -1.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5856 -0.2934 -1.3734 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1498 1.1507 1.2766 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4565 -1.5898 1.0114 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4506 -0.3141 2.3694 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1202 -1.4322 2.1388 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8609 -1.2913 -0.0184 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3127 -0.6289 1.5381 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2278 0.9524 -1.0724 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5141 2.6992 0.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 1.5918 1.8755 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 2.2800 1.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1457 0.0901 0.9518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7643 4.1355 -1.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8953 5.5926 -0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0076 4.2231 -1.1477 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 4.5809 0.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 4.0755 1.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7383 0.9423 0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 3.8485 -0.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3772 2.4146 -1.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0656 2.4944 -1.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9156 3.2141 1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 0.2503 -0.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2081 2.3303 -0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3197 1.6587 1.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9621 0.4878 -1.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2969 1.4582 -1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8138 2.3035 -0.2934 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8987 2.6700 -1.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6186 -0.1373 0.7322 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3063 -0.3586 -0.8757 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8865 -1.3294 -0.5003 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7422 -0.7959 2.0387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5332 -1.2938 0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1982 -3.0951 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3739 -1.5173 -2.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6922 -1.5178 -1.4678 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6442 -2.8409 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9497 -4.2793 -0.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5330 -4.8767 -1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -4.8954 -0.0404 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0044 -3.8535 1.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4074 -1.1286 2.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5034 -1.2925 0.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5641 -2.4080 2.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1301 -1.0763 -1.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8367 -0.6840 -2.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5271 -1.6291 -2.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5648 -2.4445 -1.7053 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 7 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 26 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 34 38 1 0 38 39 1 0 39 40 2 0 39 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 45 12 1 0 1 47 1 0 1 48 1 0 1 49 1 0 2 50 1 0 2 51 1 0 3 52 1 0 3 53 1 0 4 54 1 0 4 55 1 0 5 56 1 0 5 57 1 0 6 58 1 0 6 59 1 0 7 60 1 1 8 61 1 0 8 62 1 0 8 63 1 0 9 64 1 0 9 65 1 0 10 66 1 6 11 67 1 0 11 68 1 0 11 69 1 0 12 70 1 1 16 71 1 6 17 72 1 0 17 73 1 0 17 74 1 0 18 75 1 0 21 76 1 6 22 77 1 0 22 78 1 0 22 79 1 0 23 80 1 0 26 81 1 6 27 82 1 0 27 83 1 0 28 84 1 6 29 85 1 0 29 86 1 0 29 87 1 0 30 88 1 0 30 89 1 0 30 90 1 0 31 91 1 0 34 92 1 6 35 93 1 6 36 94 1 0 36 95 1 0 36 96 1 0 37 97 1 0 37 98 1 0 37 99 1 0 38100 1 0 41101 1 0 41102 1 0 42103 1 0 45104 1 6 46105 1 0 46106 1 0 46107 1 0 M END