RDKit 3D 122128 0 0 0 0 0 0 0 0999 V2000 -7.4324 3.7862 1.3978 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1602 2.2544 1.4078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8791 1.9414 2.8441 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4397 1.6661 0.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3054 0.1939 0.8765 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2405 -0.2727 -0.1022 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0227 -0.5960 -1.3612 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0531 -1.7042 -1.8933 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7344 0.4495 -1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7429 -1.5724 0.4185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4407 -2.0740 -0.1314 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3635 -0.9714 -0.0144 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3668 -0.6681 1.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9671 0.1007 -0.8274 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3689 0.4690 -1.9256 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1023 -0.1057 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3013 -0.3898 -1.1995 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8325 -0.5804 -1.4900 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5171 -1.4693 -2.6227 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 0.8123 -1.8392 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 0.8640 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9612 0.2547 -0.8722 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1976 -0.2664 -1.3248 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2841 0.4326 -0.8808 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9860 0.9268 -1.9615 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -0.0066 -2.8363 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7625 0.0357 -4.1591 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8603 0.8762 -4.3395 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1083 -0.8226 -5.1752 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4732 -1.4252 -2.3526 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4232 -2.1837 -3.0691 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9602 -1.4242 -0.9183 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8684 -2.6866 -0.3546 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2228 -0.4424 -0.0702 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1984 0.3604 0.5612 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1477 0.2408 1.9539 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9138 1.4916 2.4531 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9934 2.1949 2.9099 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6862 3.6767 2.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5222 3.7461 1.2467 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2005 1.8752 2.0771 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2419 2.7820 2.2931 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6197 0.4634 2.4166 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4913 0.0320 1.4027 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4167 -0.4134 2.4089 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1732 -0.8592 3.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2806 -0.7563 -0.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -2.1060 -0.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5804 -0.3969 1.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.9006 -0.1866 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7513 -2.1819 0.4158 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1927 -1.8125 0.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0107 -1.4355 -0.4387 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1759 -2.7433 -1.1823 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2397 0.7669 -0.4435 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0434 1.9148 0.4841 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8622 4.2791 2.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5025 3.9690 1.6284 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2341 4.2035 0.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4538 2.6176 3.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8029 2.2405 3.0233 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9285 0.8914 3.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5304 2.0115 -0.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3287 1.9925 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2944 -0.3001 0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0818 -0.1572 1.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3578 1.1870 -2.4646 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4882 -2.3776 0.1034 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8294 -1.6863 1.5424 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6416 -2.3359 -1.1779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1901 -2.9739 0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 0.0852 1.8122 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1461 -1.6281 1.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3706 -0.3670 1.8316 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8056 1.2719 -2.5483 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6022 0.5517 -3.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3326 -1.0447 -3.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3566 0.5563 -0.5914 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0645 -2.4413 -2.3463 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2116 -1.0457 -3.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4184 -1.6151 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7614 1.2464 -2.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6148 1.4588 -0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4848 0.4561 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 1.9657 -2.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2829 1.1270 -0.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0072 1.2793 -0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5174 0.2641 -3.0644 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6544 -1.6891 -5.4132 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 -1.9583 -2.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3099 -3.1381 -2.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0467 -1.1717 -0.9741 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6889 -2.9456 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6755 -0.9864 0.7251 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3109 -0.4684 2.2042 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1542 2.0154 3.9918 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5114 4.3162 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7089 3.9182 3.0828 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3687 4.0695 0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8845 1.8786 1.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6188 3.0000 1.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1486 0.4453 3.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5703 -0.9643 1.3671 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6169 -1.3345 1.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9208 -1.4197 4.0345 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6222 -2.3408 0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2291 -2.9538 -0.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 -2.1145 -1.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6113 -0.0515 1.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3107 -1.2101 2.1085 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9457 0.5301 1.5818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -0.0838 0.4961 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7335 -3.0437 -0.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2247 -2.3734 1.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.9182 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -2.6981 1.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8697 -2.7171 -2.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2222 -3.1350 -1.6013 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4551 -3.5050 -0.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6462 1.2814 -1.3788 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8408 2.8838 -0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0581 1.8602 1.0507 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 10 1 0 10 11 1 0 11 12 1 0 12 13 1 1 12 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 6 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 38 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 26 27 1 0 27 29 1 0 27 28 2 0 22 47 1 0 47 48 1 0 47 49 1 0 47 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 6 14 55 1 0 55 56 1 0 6 7 1 6 7 9 1 0 7 8 2 0 56 2 1 0 55 6 1 0 53 12 1 0 53 17 1 0 50 18 1 0 34 24 1 0 45 36 1 0 1 57 1 0 1 58 1 0 1 59 1 0 3 60 1 0 3 61 1 0 3 62 1 0 4 63 1 0 4 64 1 0 5 65 1 0 5 66 1 0 10 68 1 0 10 69 1 0 11 70 1 0 11 71 1 0 13 72 1 0 13 73 1 0 13 74 1 0 15 75 1 0 16 76 1 0 16 77 1 0 17 78 1 1 19 79 1 0 19 80 1 0 19 81 1 0 20 82 1 0 20 83 1 0 21 84 1 0 21 85 1 0 22 86 1 1 24 87 1 1 26 88 1 6 30 90 1 1 31 91 1 0 32 92 1 6 33 93 1 0 34 94 1 1 36 95 1 6 38 96 1 1 39 97 1 0 39 98 1 0 40 99 1 0 41100 1 6 42101 1 0 43102 1 1 44103 1 0 45104 1 6 46105 1 0 29 89 1 0 48106 1 0 48107 1 0 48108 1 0 49109 1 0 49110 1 0 49111 1 0 50112 1 1 51113 1 0 51114 1 0 52115 1 0 52116 1 0 54117 1 0 54118 1 0 54119 1 0 55120 1 6 56121 1 0 56122 1 0 9 67 1 0 M END