RDKit 3D 125125 0 0 0 0 0 0 0 0999 V2000 -10.9004 -0.8571 -1.8798 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5472 0.2628 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5137 1.1204 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2861 2.0591 -0.9007 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7608 1.7238 0.4072 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3751 1.2850 0.6092 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4517 2.3766 0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0388 1.9567 0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7853 1.7373 1.7488 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 1.3570 1.8952 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5075 2.0685 2.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0914 1.7416 2.7871 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7571 0.4836 2.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2867 0.2050 2.2432 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8654 -0.9093 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3792 -1.0916 2.9797 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0096 0.0380 3.7118 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2697 -1.1106 1.6154 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2394 -2.3252 0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6281 -2.2485 0.8512 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1918 -3.3324 0.1810 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8767 -2.8247 -0.9181 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5365 -3.8045 -1.6380 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9213 -3.4002 -2.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4631 -4.4887 -2.7888 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5395 -5.1530 -1.0180 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3960 -5.8740 -1.4247 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7426 -5.2071 0.4558 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0899 -5.2497 0.8078 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1242 -4.0203 1.1518 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4432 -4.3576 2.2934 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7057 -1.0851 1.7029 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4929 -1.0727 0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1126 -1.0830 -0.6146 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9783 -1.0427 0.9909 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5402 -2.0890 0.2628 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4301 0.2874 0.4353 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9516 0.3556 0.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.2276 1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8392 0.3268 2.1595 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5130 1.6015 1.9152 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5164 2.2161 0.5706 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1435 1.3089 -0.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0542 2.0717 -1.7868 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6209 1.4048 -2.9654 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0216 0.9833 -3.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1068 1.9861 -2.8664 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2155 2.7484 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4456 3.6788 -1.7703 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5332 4.4539 -0.4586 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8288 -0.6167 -1.7427 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8863 -1.8121 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3560 -1.0415 -0.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0412 -0.2448 -3.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7373 0.8742 -3.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9862 1.7573 -2.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4254 0.4645 -1.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6183 2.9034 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2466 2.7121 -0.7565 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8725 2.6753 1.0522 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4774 1.0245 0.9839 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2481 1.2983 1.7723 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0019 0.3371 0.3467 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6051 3.3266 0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6332 2.5424 -1.0056 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3852 2.7960 -0.0789 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7447 1.0657 -0.3048 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3306 0.8151 2.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9606 2.6228 2.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 0.4699 1.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 2.9603 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7765 1.6421 3.8467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4206 2.5438 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9757 0.6179 0.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3073 -0.3913 2.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5416 0.9410 1.9426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5173 -1.6787 3.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2038 -1.9760 3.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9648 -0.0268 3.9422 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0457 -0.2188 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -3.2159 1.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1879 -2.3319 -0.1464 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3968 -4.0243 -0.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9478 -3.9022 -2.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6021 -3.1490 -1.2541 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8952 -2.5624 -2.8128 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -4.6249 -2.6174 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3952 -5.7283 -1.4829 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0969 -5.5851 -2.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2376 -6.1313 0.8671 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2683 -6.0400 1.3761 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9052 -3.2543 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6135 -5.2873 2.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5242 -0.4227 -1.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1467 -1.1168 2.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -2.8130 0.0979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9285 1.1290 0.9209 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1858 0.3746 -0.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2764 -0.6094 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3438 1.1419 -0.0819 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 -0.8030 2.3422 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9046 1.0008 2.6085 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2948 -0.5243 1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0308 -0.0354 3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6197 1.4369 2.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2322 2.3899 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 2.7883 0.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 3.0707 0.6782 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2105 1.2006 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6173 0.3646 -0.6055 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9003 2.0534 -1.9855 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2287 3.1391 -1.6733 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4766 2.1318 -3.8373 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9477 0.5437 -3.3047 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2201 0.4668 -4.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2655 0.1591 -2.2745 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0794 1.3900 -2.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1786 2.6559 -3.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3828 3.3383 -1.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5164 2.0989 -0.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3690 3.0888 -1.8817 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3032 4.3468 -2.6222 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1075 5.4724 -0.6767 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5756 4.5744 -0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9578 3.9816 0.3486 H 0 0 0 0 0 0 0 0 0 0 0 0 50 49 1 0 49 48 1 0 48 47 1 0 47 46 1 0 46 45 1 0 45 44 1 0 44 43 1 0 43 42 1 0 42 41 1 0 41 40 1 0 40 39 1 0 39 38 1 0 38 37 1 0 37 35 1 0 35 36 1 0 35 33 1 0 33 34 1 0 33 32 2 0 32 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 23 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 18 16 1 0 16 17 1 0 16 15 1 0 15 14 2 0 14 13 1 0 13 12 1 0 12 11 1 0 11 10 2 0 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 1 0 30 21 1 0 50123 1 0 50124 1 0 50125 1 0 49121 1 0 49122 1 0 48119 1 0 48120 1 0 47117 1 0 47118 1 0 46115 1 0 46116 1 0 45113 1 0 45114 1 0 44111 1 0 44112 1 0 43109 1 0 43110 1 0 42107 1 0 42108 1 0 41105 1 0 41106 1 0 40103 1 0 40104 1 0 39101 1 0 39102 1 0 38 99 1 0 38100 1 0 37 97 1 0 37 98 1 0 35 95 1 1 36 96 1 0 34 94 1 0 18 80 1 6 19 81 1 0 19 82 1 0 21 83 1 6 23 84 1 6 24 85 1 0 24 86 1 0 25 87 1 0 26 88 1 6 27 89 1 0 28 90 1 1 29 91 1 0 30 92 1 1 31 93 1 0 16 78 1 1 17 79 1 0 15 77 1 0 14 76 1 0 13 74 1 0 13 75 1 0 12 72 1 0 12 73 1 0 11 71 1 0 10 70 1 0 9 68 1 0 9 69 1 0 8 66 1 0 8 67 1 0 7 64 1 0 7 65 1 0 6 62 1 0 6 63 1 0 5 60 1 0 5 61 1 0 4 58 1 0 4 59 1 0 3 56 1 0 3 57 1 0 2 54 1 0 2 55 1 0 1 51 1 0 1 52 1 0 1 53 1 0 M END