RDKit 3D 112116 0 0 0 0 0 0 0 0999 V2000 9.2995 -3.8524 0.4349 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2328 -2.8127 0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7721 -2.2483 1.2483 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8066 -2.5234 -1.0224 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8122 -1.5713 -1.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5273 -1.9718 -0.6827 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4950 -1.0472 -0.9639 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6241 -1.0970 0.1648 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4919 -0.3961 -0.0962 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2657 0.7459 0.7098 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4038 0.3738 2.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3806 1.6768 0.3977 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5969 2.9395 1.0922 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5412 3.9534 1.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7862 5.0676 0.3109 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0732 5.2867 -0.3843 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7259 6.0979 0.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9196 1.2611 0.3812 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9146 1.6100 -1.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5491 1.8599 -1.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2654 1.1647 -0.3271 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7227 2.1869 0.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1895 0.2305 0.2713 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6760 -0.4151 1.4785 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1719 -1.4859 1.8557 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9901 -1.1494 1.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -0.2956 0.4677 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3326 -0.8936 0.3313 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2901 -2.2881 -0.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9061 -1.0125 1.7483 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1463 -0.1489 1.9105 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1876 -0.5544 0.9117 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.5643 -1.8753 1.1364 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6641 -0.2999 -0.4625 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0312 -1.4147 -1.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3904 0.9545 -0.9785 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2142 0.0318 -0.4315 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6434 0.2370 -1.8179 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4796 1.0371 -2.6107 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3691 1.0338 -1.6301 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3747 0.2449 -0.8021 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8228 -0.7839 -1.7319 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2332 -2.5791 0.2637 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8510 -3.2262 1.3077 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5216 -3.3012 -1.0616 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8476 -2.6751 -2.0847 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0241 -3.3029 -1.2561 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5303 -4.3808 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0758 -4.7330 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3069 -4.1934 1.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2879 -3.4205 0.1746 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6708 -1.4786 -2.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1587 -0.6020 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6452 -2.0386 0.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2516 -0.7892 0.9964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5213 0.6908 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 0.9217 2.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6474 -0.6810 2.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4323 1.8600 -0.7364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3446 1.0680 0.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8055 2.7501 2.2059 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5522 3.4630 0.7123 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5724 3.8931 1.5387 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9357 5.4187 0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3129 4.4367 -1.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 6.2035 -1.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 7.0437 -0.1093 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2724 6.1738 1.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8923 5.7744 -0.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5561 2.1399 0.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1901 0.6869 -1.7134 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5601 2.4648 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8597 1.5937 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6755 2.9819 -1.3673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1522 3.1543 0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5985 1.9258 1.7095 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7808 2.5045 0.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1158 -0.4968 -0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7727 0.1940 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1378 -1.8843 2.7031 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7323 -2.0880 0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3538 -1.4534 2.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1194 0.6113 1.1342 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9112 -2.3725 -1.2397 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5917 -2.8757 0.4353 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -2.7988 -0.0751 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1975 -2.0360 1.9997 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2052 -0.6629 2.5152 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9351 0.9185 1.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5535 -0.4164 2.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1072 0.0586 1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5325 -1.9979 0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8559 -1.1284 -2.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4988 -2.2457 -0.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2090 -1.7691 -2.0297 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7822 1.8522 -0.8502 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7312 0.8072 -2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3339 1.1191 -0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1253 1.0424 0.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -0.7003 -2.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1148 1.9136 -2.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9318 1.1581 -2.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6084 2.0173 -1.2597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8791 -0.4316 -2.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5846 -1.7530 -1.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5051 -0.9969 -2.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1382 -2.7005 0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0092 -2.6197 2.0467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1408 -4.3161 -0.9481 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.0606 -2.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2845 -3.3141 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0358 -5.1775 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 16 15 1 0 15 17 1 0 15 14 2 3 14 13 1 0 13 12 1 0 12 10 1 0 10 11 1 0 10 9 1 6 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 47 1 0 47 48 1 0 47 45 1 0 45 46 1 0 45 43 1 0 43 44 1 0 10 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 1 21 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 6 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 34 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 1 6 43 8 1 0 23 18 1 0 41 27 1 0 41 21 1 0 37 28 1 0 16 64 1 0 16 65 1 0 16 66 1 0 17 67 1 0 17 68 1 0 17 69 1 0 14 63 1 0 13 61 1 0 13 62 1 0 12 59 1 0 12 60 1 0 11 56 1 0 11 57 1 0 11 58 1 0 8 55 1 1 6 54 1 1 5 52 1 0 5 53 1 0 1 49 1 0 1 50 1 0 1 51 1 0 47111 1 6 48112 1 0 45109 1 1 46110 1 0 43107 1 1 44108 1 0 18 70 1 1 19 71 1 0 19 72 1 0 20 73 1 0 20 74 1 0 22 75 1 0 22 76 1 0 22 77 1 0 23 78 1 6 24 79 1 1 25 80 1 0 26 81 1 0 26 82 1 0 27 83 1 1 29 84 1 0 29 85 1 0 29 86 1 0 30 87 1 0 30 88 1 0 31 89 1 0 31 90 1 0 32 91 1 1 33 92 1 0 35 93 1 0 35 94 1 0 35 95 1 0 36 96 1 0 36 97 1 0 36 98 1 0 37 99 1 1 38100 1 6 39101 1 0 40102 1 0 40103 1 0 42104 1 0 42105 1 0 42106 1 0 M END