RDKit 3D 124130 0 0 0 0 0 0 0 0999 V2000 3.0881 1.7017 -2.9711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9318 0.6961 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4724 -0.0804 -1.3495 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0776 0.0721 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6325 1.2787 -0.7699 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2205 1.5189 -0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 0.3512 -0.8188 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0813 0.5463 -0.7833 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5975 0.9565 0.5399 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4582 1.6522 -1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9437 1.8982 -1.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7783 0.6522 -1.6032 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4352 0.6574 -0.3738 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7971 0.8050 -0.4436 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.1949 2.0743 0.0515 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6016 2.0621 -0.0417 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.1579 3.4342 -0.0948 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4386 4.4659 -0.0601 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5139 3.5833 -0.1858 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0726 1.4246 1.2539 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.4400 1.4071 1.3872 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4211 0.0776 1.3567 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6727 -0.0724 2.5143 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2934 -1.3059 3.4591 S 0 0 1 0 0 6 0 0 0 0 0 0 -7.2046 -2.1887 4.0047 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1314 -0.7015 4.5466 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3314 -2.2846 2.5368 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5853 -0.2988 0.1593 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.3931 -0.9608 -0.7942 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0509 -0.6007 -1.9166 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8747 -1.7788 -1.4334 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0766 -0.7405 -3.4538 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6732 -0.7120 -1.3737 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4280 -1.8393 -0.4235 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9271 -2.1274 -0.4779 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -0.8878 -0.1518 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1246 -0.8145 1.3598 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2936 -1.1733 -0.6572 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2841 -1.9931 -1.9173 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1342 -1.9124 0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4521 -2.2799 -0.2387 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3174 -1.1534 -0.6799 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1647 -0.5680 0.3646 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1316 0.6916 0.5459 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0172 -1.2593 1.1928 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8162 -0.6364 2.1859 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1617 -0.9089 2.0281 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8713 0.1334 2.6170 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3114 -0.2469 2.8813 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9439 0.8459 3.4707 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1964 0.7263 3.8052 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6147 1.9881 3.5363 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2533 -0.1855 4.5283 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9139 -0.9588 5.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4225 -1.0366 3.5828 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0587 -0.8030 3.7621 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2528 -1.6496 -1.7838 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1317 -0.4687 -2.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3519 0.6341 -2.7871 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0544 1.9670 -2.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0148 1.4416 -3.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3461 1.6997 -4.1044 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3171 2.7574 -2.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 2.1300 -0.8737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0688 2.4625 -0.9091 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1459 1.7860 0.6953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3352 0.2265 -1.9179 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7328 1.2421 1.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1659 0.2250 1.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1863 1.9237 0.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0731 1.3709 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0017 2.6306 -1.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1472 2.3927 -2.7913 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2847 2.6382 -1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6173 0.7619 -2.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 0.8749 -1.5347 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9495 1.5129 -0.9296 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0028 4.4205 -0.4983 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6254 2.0521 2.0784 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6498 1.4269 2.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2450 -0.6720 1.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8617 -2.7636 1.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8798 -1.0840 0.5246 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1613 -0.6254 -1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9085 -1.6014 -1.7988 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -2.7185 -1.9825 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8134 -1.9133 -0.3463 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0173 0.2515 -3.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2128 -1.3812 -3.7144 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9905 -1.2531 -3.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0057 -0.9311 -2.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8008 -1.7089 0.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8968 -2.7900 -0.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7368 -2.5485 -1.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7082 -2.9049 0.2766 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1752 -1.0153 1.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.6937 1.7353 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3226 0.0745 1.7851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2954 -1.8810 -2.4156 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5776 -1.6107 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2018 -3.0844 -1.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6324 -2.8812 0.6208 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3635 -1.2902 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0254 -2.8134 0.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3492 -3.0815 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5993 0.4500 2.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9159 0.9416 1.8279 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7970 -0.3987 1.8877 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3914 -1.1665 3.4895 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3264 1.4212 2.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0145 0.9727 4.5469 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2295 2.4230 2.8776 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5463 0.4645 5.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8862 -0.8180 5.3477 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6456 -2.0839 3.7961 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8077 0.1207 3.4763 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8731 -2.4269 -1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7087 -1.9442 -2.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9156 -0.8513 -2.8205 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6605 -0.0443 -1.2624 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3482 0.4082 -3.8851 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1558 1.7389 -2.6327 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8263 2.4685 -1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7755 2.5962 -3.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 1 36 7 1 0 7 6 1 0 6 5 1 0 5 4 2 0 4 3 1 0 3 2 2 0 2 1 1 0 2 59 1 0 59 60 1 0 59 58 1 0 58 57 1 0 57 42 1 0 42 41 1 0 41 40 1 0 40 38 1 0 38 39 1 6 42 43 1 1 43 44 2 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 48 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 7 8 1 0 8 9 1 1 8 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 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 24 23 1 6 24 27 1 0 24 25 2 0 24 26 2 0 22 28 1 0 28 29 1 0 16 17 1 0 17 19 1 0 17 18 2 0 12 30 1 0 30 31 1 1 30 32 1 0 8 33 1 0 28 14 1 0 30 33 1 0 38 36 1 0 55 46 1 0 38 4 1 0 42 3 1 0 33 91 1 6 34 92 1 0 34 93 1 0 35 94 1 0 35 95 1 0 37 96 1 0 37 97 1 0 37 98 1 0 7 67 1 6 6 65 1 0 6 66 1 0 5 64 1 0 1 61 1 0 1 62 1 0 1 63 1 0 59121 1 6 60122 1 0 60123 1 0 60124 1 0 58119 1 0 58120 1 0 57117 1 0 57118 1 0 41104 1 0 41105 1 0 40102 1 0 40103 1 0 39 99 1 0 39100 1 0 39101 1 0 46106 1 1 48107 1 6 49108 1 0 49109 1 0 50110 1 0 51111 1 1 52112 1 0 53113 1 1 54114 1 0 55115 1 1 56116 1 0 9 68 1 0 9 69 1 0 9 70 1 0 10 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 6 14 76 1 6 16 77 1 6 20 79 1 1 21 80 1 0 22 81 1 1 27 82 1 0 28 83 1 1 29 84 1 0 19 78 1 0 31 85 1 0 31 86 1 0 31 87 1 0 32 88 1 0 32 89 1 0 32 90 1 0 M END