RDKit 3D 191201 0 0 0 0 0 0 0 0999 V2000 6.1591 -1.5338 -3.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6788 -1.5488 -2.8500 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0815 -0.3158 -2.9062 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4461 0.5466 -1.8749 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7394 1.7432 -2.1158 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5516 2.7851 -1.7567 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7462 3.9247 -1.0970 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7452 4.7180 -0.4855 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 5.4265 -1.5016 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2675 4.4339 -2.2603 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0575 5.0476 -3.2082 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3101 3.4150 -2.8924 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0282 2.4868 -3.6315 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8267 3.3901 -0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 3.8987 0.7434 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1894 3.4814 1.9424 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9609 4.9570 0.5176 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7898 6.2143 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1085 7.4532 0.9492 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7658 7.1698 2.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8985 6.7557 3.2492 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1601 8.4836 2.9225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3843 6.1957 2.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0235 4.9019 1.6695 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1531 4.0016 1.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5721 2.8977 1.9332 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4858 1.7113 0.9617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5232 1.8904 -0.1312 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5666 0.8233 -0.1357 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1573 -0.1569 -1.2444 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5928 -0.0332 1.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8038 -0.8015 1.3919 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4135 -0.2832 2.5745 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -0.9629 0.3222 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8351 -2.1217 -0.3914 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1933 -3.2212 0.0118 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2342 -4.1340 -1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5163 -4.0937 -1.6086 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6420 -5.1165 -2.7399 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9551 -5.0155 -3.2245 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5896 -4.3520 -0.5801 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.3189 -3.2162 -0.2626 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 -4.9558 0.6225 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.8017 -5.2164 1.6592 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8927 -3.9432 1.1450 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0686 -4.4904 2.0866 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8509 -4.9428 1.6961 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7968 -5.6426 0.5214 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4811 -5.7387 0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5977 -6.4089 1.1623 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7362 -7.3405 0.5849 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6274 -7.2704 0.5343 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2335 -8.2987 0.0783 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4715 -6.1388 0.9482 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4524 -5.7074 -0.1211 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6879 -6.5962 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -5.8656 -1.3454 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9183 -4.2880 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2636 -3.4100 -0.8603 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0562 -3.5848 -1.1307 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9637 -2.4130 -1.4728 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3503 -2.2697 -1.5379 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7951 -1.3707 -0.4059 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1552 -1.0295 -0.4968 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8294 -1.3600 0.6788 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7962 -2.3122 0.3119 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8051 -1.6829 -0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7627 -0.9461 0.5063 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7870 -1.8318 0.8767 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9499 -0.5677 1.7228 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8488 -1.6647 2.5516 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5605 -0.1527 1.2224 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7477 0.8335 0.2797 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0349 -0.0645 -0.5458 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3384 0.8050 0.5013 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5609 -7.0533 2.1525 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9181 -7.7437 3.1474 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3385 -5.8941 2.7885 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4128 -6.4802 3.4731 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0005 0.2651 -0.5430 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1034 -0.3176 -1.9917 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4219 0.7648 -0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7429 1.0740 0.9584 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9536 1.2897 -0.5161 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3640 2.5352 0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2263 3.3818 0.7137 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0261 3.3140 -0.1825 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4560 3.6542 -1.6164 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9727 4.3612 0.1303 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7888 5.6196 0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0504 4.6007 -1.0329 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3899 4.5984 -0.8140 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9014 3.3505 -1.2857 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6767 -2.2472 -2.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6169 -0.5499 -2.9962 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3958 -1.9100 -4.1401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2139 -2.1746 -3.6442 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5396 0.7221 -1.8209 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3203 2.4736 -0.9901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3015 4.4756 -1.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0312 6.1859 -1.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6732 5.8702 -2.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8515 3.8676 -1.5075 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9911 5.0381 -2.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6087 4.0125 -3.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9521 2.4809 -3.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7305 6.1380 1.1058 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1152 6.4111 -0.5699 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8013 8.2893 0.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1566 7.6202 0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9647 5.7044 3.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7971 7.3006 4.2379 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8597 7.1796 2.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 9.2686 3.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4505 8.3036 3.8198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5397 8.8141 2.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6769 6.0049 3.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1905 6.7800 1.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6798 4.5130 2.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9765 2.6070 2.8927 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 1.7942 0.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4764 0.7794 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9049 1.8408 -1.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4886 0.2010 -2.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3417 -1.1952 -0.9959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0205 -0.1069 -1.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7237 -0.7298 1.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3905 0.6515 1.9571 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5402 -1.8426 1.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7186 -0.3841 3.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8002 -1.1052 0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1049 -3.1147 0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7714 -3.1251 -2.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4286 -6.1242 -2.3869 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9737 -4.7518 -3.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3580 -4.1626 -2.9672 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3333 -5.1125 -0.9585 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9861 -3.4914 0.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4635 -5.8984 0.3258 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3619 -5.8987 2.2585 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5288 -3.1714 1.6725 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1198 -4.1072 1.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0735 -4.7713 -0.2216 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4488 -6.4008 -0.8132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -5.5867 1.7033 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0867 -6.5078 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9099 -5.2700 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -7.6368 -0.3394 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3479 -6.2177 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2018 -6.5817 0.8642 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9205 -6.2567 -1.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5686 -3.9574 1.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0221 -4.2063 0.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9031 -3.2299 -1.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5639 -1.8282 0.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1614 -1.8154 1.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3392 -2.4780 -0.9867 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3728 -0.9346 -1.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2137 -0.0708 0.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8268 -2.6043 0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3675 0.2778 2.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5179 -2.3282 2.3074 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9989 0.2397 2.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1332 1.5761 0.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9522 -0.2839 -0.6122 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6433 0.3248 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2176 -7.7175 1.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0155 -8.0731 2.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6382 -5.3898 3.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8161 -7.1639 2.8612 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0435 0.4829 -2.7307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4143 -1.1606 -2.1313 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1185 -0.7592 -2.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6798 1.5751 -1.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1601 -0.0509 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3705 1.8529 1.0064 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8072 1.5732 -1.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0175 2.3754 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9965 3.2209 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9957 2.9538 1.7092 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6367 4.3658 0.9212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0433 2.9457 -2.3549 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 3.8508 -1.7035 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0584 4.6565 -1.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2088 5.7541 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7189 5.6185 -0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2766 6.5138 -0.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3258 5.5641 -1.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2892 3.8138 -1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8799 5.3079 -1.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3211 3.0129 -2.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 12 1 0 12 13 1 0 12 10 1 0 10 11 1 0 10 9 1 0 9 8 1 0 8 7 1 0 7 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 6 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 6 29 31 1 0 31 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 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 54 55 1 0 55 56 1 0 55 57 1 6 55 58 1 0 58 59 1 0 59 60 2 0 59 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 64 65 1 0 65 66 1 0 66 67 1 0 67 68 1 0 68 69 1 0 68 70 1 0 70 71 1 0 70 72 1 0 72 73 1 0 63 74 1 0 74 75 1 0 50 76 1 0 76 77 1 0 76 78 1 0 78 79 1 0 34 80 1 0 80 81 1 6 80 82 1 0 82 83 1 0 80 84 1 0 84 85 1 0 85 86 1 0 86 87 1 0 87 88 1 6 87 89 1 0 89 90 1 1 89 91 1 0 91 92 1 0 92 93 1 0 62 2 1 0 72 65 1 0 74 4 1 0 7 6 1 0 24 17 1 0 89 25 1 0 92 17 1 0 87 28 1 0 84 29 1 0 45 36 1 0 78 47 1 0 1 94 1 0 1 95 1 0 1 96 1 0 2 97 1 6 4 98 1 1 6 99 1 1 12105 1 6 13106 1 0 10103 1 1 11104 1 0 9101 1 0 9102 1 0 7100 1 6 18107 1 0 18108 1 0 19109 1 0 19110 1 0 21111 1 0 21112 1 0 21113 1 0 22114 1 0 22115 1 0 22116 1 0 23117 1 0 23118 1 0 24119 1 1 26120 1 0 27121 1 0 27122 1 0 28123 1 6 30124 1 0 30125 1 0 30126 1 0 31127 1 0 31128 1 0 32129 1 1 33130 1 0 34131 1 1 36132 1 1 38133 1 6 39134 1 0 39135 1 0 40136 1 0 41137 1 6 42138 1 0 43139 1 6 44140 1 0 45141 1 1 47142 1 6 49143 1 0 49144 1 0 50145 1 1 54146 1 0 54147 1 0 56148 1 0 56149 1 0 56150 1 0 57151 1 0 58152 1 0 58153 1 0 62154 1 6 63155 1 1 65156 1 1 67157 1 0 67158 1 0 68159 1 6 69160 1 0 70161 1 1 71162 1 0 72163 1 1 73164 1 0 74165 1 6 75166 1 0 76167 1 6 77168 1 0 78169 1 1 79170 1 0 81171 1 0 81172 1 0 81173 1 0 82174 1 0 82175 1 0 83176 1 0 84177 1 6 85178 1 0 85179 1 0 86180 1 0 86181 1 0 88182 1 0 88183 1 0 88184 1 0 90185 1 0 90186 1 0 90187 1 0 91188 1 0 91189 1 0 92190 1 6 93191 1 0 M END