RDKit 3D 103104 0 0 0 0 0 0 0 0999 V2000 -0.2524 6.9164 0.0777 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2003 5.7064 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4569 4.5170 0.2304 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4092 4.5328 -1.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0536 3.5238 0.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 2.3787 0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1568 2.5683 0.0567 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1070 3.0885 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 1.4299 -0.0794 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0051 0.3963 -0.7845 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8593 -0.6052 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7708 -1.7947 -1.6893 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1752 -1.3198 -3.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3457 -2.3102 -1.8791 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9959 -3.0106 -0.6755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3779 -3.4228 -2.9151 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9905 -4.0659 -2.9798 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9677 -0.5544 -0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0456 -1.5739 0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1093 0.5254 0.8297 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1218 0.6196 1.6228 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1676 1.5014 0.8082 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3479 2.6862 1.6989 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0161 1.1023 0.3223 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8059 0.6079 -1.0939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 0.7827 1.1426 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2321 1.7338 1.0028 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 2.3037 2.1479 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2771 1.9362 3.2614 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8566 3.2857 2.1167 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3073 3.4508 0.6825 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.5561 0.6427 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1543 -1.7060 0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9997 -0.6126 0.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7674 -1.7568 -0.2135 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3119 -1.4335 -1.6275 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8733 -2.2688 0.5857 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -2.2996 0.0412 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1678 -2.7229 0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4897 -2.7033 -0.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3428 -1.5410 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -3.2041 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3317 -3.7347 2.5975 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9016 -3.2073 2.5442 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8225 -3.6418 3.7422 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7925 -2.7392 1.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4522 -2.7302 2.5622 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2682 7.2593 0.4022 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4255 7.7711 0.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3313 6.5951 -0.9773 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1416 5.8208 1.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2808 5.6151 0.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3386 2.7038 -0.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5439 3.4252 0.5922 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3449 2.6057 -2.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9845 4.1790 -1.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1608 2.9302 -1.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3861 -2.6268 -1.4242 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9359 -0.5375 -3.0175 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5648 -2.2141 -3.6749 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2509 -0.9201 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5882 -1.5841 -2.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7432 -2.8963 -0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7686 -3.0971 -3.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0387 -4.2431 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4219 -3.8240 -2.0336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4139 -3.6912 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0934 -5.1758 -3.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0205 -0.9678 0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0339 -2.1503 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1827 -2.1793 -0.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 2.7083 2.5328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3695 3.6311 1.1042 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3639 2.6469 2.1761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8516 0.3406 0.6828 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6534 0.4050 -1.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2917 1.5059 -1.6316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0085 -0.1592 -1.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0527 0.6392 2.1853 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 4.2983 2.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7131 3.0279 2.7849 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8882 4.4146 0.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9864 2.6170 0.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4073 3.4911 0.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2295 -2.1821 1.6641 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.5346 -0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2084 -1.4415 0.4109 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5971 0.3129 0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0418 -2.6216 -0.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8595 -0.4589 -1.4644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4579 -1.3357 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0011 -2.2158 -1.9799 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0269 -3.6416 -0.0803 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2404 -2.4896 -1.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3067 -1.4225 1.4436 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0168 -0.5734 -0.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3793 -1.7285 0.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2008 -3.7434 1.9337 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1545 -4.7944 2.9245 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5425 -3.1956 3.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5913 -3.2569 3.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7565 -3.3807 2.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 -1.7385 2.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 17 16 1 0 16 14 1 0 14 15 1 0 14 12 1 0 12 13 1 0 12 11 1 0 11 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 22 9 2 0 9 10 1 0 9 7 1 0 7 8 1 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 1 0 6 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 26 32 1 0 32 33 1 0 32 34 2 0 34 35 1 0 35 36 1 0 35 37 1 0 37 46 2 0 46 47 1 0 46 44 1 0 44 45 2 0 44 42 1 0 42 43 1 0 42 39 2 0 39 40 1 0 40 41 1 0 39 38 1 0 10 11 1 0 38 37 1 0 17 66 1 0 17 67 1 0 17 68 1 0 16 64 1 0 16 65 1 0 14 62 1 6 15 63 1 0 12 58 1 1 13 59 1 0 13 60 1 0 13 61 1 0 19 69 1 0 19 70 1 0 19 71 1 0 23 72 1 0 23 73 1 0 23 74 1 0 7 54 1 1 8 55 1 0 8 56 1 0 8 57 1 0 6 53 1 0 2 51 1 0 2 52 1 0 1 48 1 0 1 49 1 0 1 50 1 0 24 75 1 1 25 76 1 0 25 77 1 0 25 78 1 0 26 79 1 1 30 80 1 0 30 81 1 0 31 82 1 0 31 83 1 0 31 84 1 0 33 85 1 0 33 86 1 0 33 87 1 0 34 88 1 0 35 89 1 6 36 90 1 0 36 91 1 0 36 92 1 0 47101 1 0 47102 1 0 47103 1 0 43 98 1 0 43 99 1 0 43100 1 0 40 93 1 0 40 94 1 0 41 95 1 0 41 96 1 0 41 97 1 0 M END