RDKit 3D 106108 0 0 0 0 0 0 0 0999 V2000 11.4590 3.6154 0.9148 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7023 2.3402 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 1.4627 0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8769 0.1714 -0.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8920 0.1772 -1.8469 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0062 -1.1148 -2.6158 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6911 -2.2603 -1.6845 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2751 -2.0316 -1.1874 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 -1.8731 0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7351 -1.6450 0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5185 -1.5180 -0.1112 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4756 -0.3429 -1.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1718 -0.3247 -1.8485 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0574 -0.1665 -0.9052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1929 0.1257 0.3073 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7619 -0.3371 -1.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6244 -0.2038 -0.5156 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0188 -1.5211 -0.1624 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5436 -2.1352 0.9305 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4373 -0.9539 0.2018 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3023 -2.1609 0.4051 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6969 -2.0250 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -1.3317 -0.0914 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4902 0.0961 -0.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1019 -1.6264 0.3261 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.9143 -0.9072 -0.5507 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4534 -1.3067 1.7239 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3460 0.1327 2.1303 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8241 -1.8062 2.0755 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 -1.2290 1.2466 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8613 -0.4765 1.8046 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9527 0.1129 1.0589 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1556 -0.0423 -0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2246 0.5391 -0.9684 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1136 1.3008 -0.2506 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9318 1.4713 1.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8833 0.8986 1.7526 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2633 -0.1887 1.3045 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0471 1.1417 1.2045 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9648 2.0034 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8639 1.5544 2.7529 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7746 3.3792 1.8955 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9093 1.7321 -0.1539 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0971 2.2944 -0.6502 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1562 2.7601 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0791 3.8867 -0.8051 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 2.5843 0.2044 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5025 0.5682 -1.0695 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3391 1.0047 -2.4528 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1229 0.6228 -3.3409 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6913 1.8521 -2.8007 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6434 -0.2822 -0.9945 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9232 3.5413 1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 4.4687 0.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3800 3.7274 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6741 2.1381 -0.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7433 1.6796 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7313 -0.6230 0.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9261 0.1583 -1.1022 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0098 1.0519 -2.5054 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8480 0.2355 -1.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0515 -1.2171 -3.0281 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2901 -1.0767 -3.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6131 -3.1639 -2.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3803 -2.3949 -0.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4801 -2.0246 -1.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8919 -1.9242 0.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7877 -0.7213 1.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6014 -2.4665 1.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -1.5529 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 -2.4516 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 0.5630 -0.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3549 -0.1147 -1.6088 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1294 -1.2451 -2.4439 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2284 0.5999 -2.4779 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9827 0.1750 0.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2242 -2.1683 -1.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6629 -1.4625 1.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1254 -2.9081 -0.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7873 -2.7222 1.2627 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1631 -3.0582 0.9714 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7208 -1.6049 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6195 -1.8713 -1.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8559 0.5634 0.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5023 0.6055 -0.3034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2135 0.3237 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2884 -2.7261 0.1138 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9634 -1.4159 -1.3957 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7467 -1.8450 2.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7642 0.2575 3.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9637 0.8242 1.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3057 0.4824 2.2235 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0393 -1.5461 3.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8856 -2.9223 2.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9789 -1.4161 0.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7854 -0.3117 2.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4470 -0.6470 -0.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3214 0.3732 -2.0308 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9555 1.7591 -0.7744 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6555 2.0835 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7340 1.0311 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0345 1.3247 1.7074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3509 3.9203 1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8716 2.8387 -1.4446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7991 3.0219 1.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 2.5520 -3.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 1 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 2 0 20 52 1 0 52 48 1 0 48 49 1 6 49 51 1 0 49 50 2 0 48 43 1 0 43 44 1 6 43 39 1 0 39 38 1 0 39 40 1 0 40 42 1 0 40 41 2 0 43 45 1 0 45 47 1 0 45 46 2 0 48 17 1 0 38 20 1 0 37 32 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 3 57 1 0 4 58 1 0 4 59 1 0 5 60 1 0 5 61 1 0 6 62 1 0 6 63 1 0 7 64 1 0 7 65 1 0 8 66 1 0 9 67 1 0 10 68 1 0 10 69 1 0 11 70 1 0 11 71 1 0 12 72 1 0 12 73 1 0 13 74 1 0 13 75 1 0 17 76 1 1 18 77 1 6 19 78 1 0 21 79 1 0 21 80 1 0 22 81 1 0 22 82 1 0 23 83 1 6 24 84 1 0 24 85 1 0 24 86 1 0 25 87 1 1 26 88 1 0 27 89 1 1 28 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 31 96 1 0 33 97 1 0 34 98 1 0 35 99 1 0 36100 1 0 37101 1 0 51106 1 0 44104 1 0 39102 1 1 42103 1 0 47105 1 0 M END