RDKit 3D 197197 0 0 0 0 0 0 0 0999 V2000 -6.0062 -3.7624 -5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9310 -2.7479 -5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5881 -3.3007 -5.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4942 -4.4591 -4.9657 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4171 -2.4492 -5.4348 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0913 -3.1813 -5.2865 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0812 -3.7846 -3.9912 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0299 -2.1413 -5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3843 -2.7025 -5.1583 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6381 -3.5560 -6.4257 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5468 -1.8017 -4.9157 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5534 -1.1207 -3.6004 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5304 -0.2314 -3.2295 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.8032 -3.9224 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.1101 -5.0704 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 1.5854 -3.2065 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1645 3.0204 -3.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2833 3.4237 -1.7966 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4234 4.3806 -1.6265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5072 2.0984 -1.0863 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2794 1.1585 -1.8389 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9157 0.0136 -1.3228 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6609 -0.7204 -2.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7608 -0.4079 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3379 -1.4685 0.5488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 -1.9741 1.9347 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3143 -1.1514 2.7948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -3.4016 1.9255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -3.8750 3.3454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -0.5267 -3.2425 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8302 0.6773 -2.8178 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1293 -1.1692 -3.3253 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3500 -0.4934 -2.9083 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2418 0.0429 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6683 -0.7586 -0.6947 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6806 1.2707 -1.0434 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5714 1.7678 0.3215 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1208 3.1955 0.3995 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5058 0.9655 1.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 1.6889 0.7681 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 1.2571 -0.0175 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6734 2.0557 2.0636 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2846 1.8997 2.3581 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0627 0.6807 3.2565 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7907 0.7378 4.5537 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4157 1.9039 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4459 -0.5308 5.3366 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5446 3.0170 2.9153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1629 4.0267 3.3515 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1193 3.0057 2.9866 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2969 4.0305 3.5556 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4146 5.1664 2.4208 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4059 6.3352 2.8400 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0224 6.9492 4.1362 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3522 7.3679 1.7441 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1418 3.7047 3.4532 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5393 3.3839 2.3044 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0341 3.7353 4.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4275 3.5023 4.6036 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8601 3.3095 6.0345 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0963 4.9136 4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1031 2.5944 3.7056 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 2.2870 2.5659 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3603 1.9503 4.0626 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0588 1.1133 3.1516 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2560 0.5125 3.8543 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6815 2.0191 2.0511 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3017 0.0323 2.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1643 -0.2530 2.8735 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8801 -0.6988 1.4003 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2859 -1.7271 0.6522 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9014 -3.0102 1.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2717 -3.8885 0.3216 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1857 -3.4666 -0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7526 -5.1694 0.5779 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1347 -5.9623 -0.4809 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7367 -6.3805 -0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9691 -7.0906 -0.9648 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3451 -8.0812 -0.0123 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -9.0020 -0.7432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2522 -8.9540 0.4065 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9568 0.4261 -3.8790 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1442 1.4784 -4.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6325 -0.2828 -5.0423 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6999 -1.1305 -5.8351 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8008 -1.0805 -4.5228 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2813 -3.7272 -4.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6716 -4.7913 -5.5299 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8567 -3.5396 -5.9646 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9118 -2.5483 -6.7338 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0892 -1.7696 -5.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4176 -1.6078 -4.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3454 -1.9308 -6.4324 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9662 -3.9566 -6.0171 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5677 -3.1695 -3.3525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1443 -1.5609 -4.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0919 -1.4811 -6.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3479 -3.5213 -4.3465 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4603 -2.9263 -7.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9434 -4.4207 -6.4659 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6739 -3.9943 -6.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5028 -2.3927 -5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5441 -1.0131 -5.7231 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.0212 -2.8673 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2084 -0.3493 -2.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1492 1.3989 -3.7417 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6604 3.6431 -3.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1126 3.2162 -3.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6747 3.8251 -1.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3865 5.1150 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 3.7865 -1.7544 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4568 4.8610 -0.6292 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5904 1.8990 -1.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2182 2.2104 -0.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1411 0.1831 0.7032 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9789 -2.0767 -0.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1974 -2.0220 2.4233 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6527 -0.9633 2.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -0.2389 3.1512 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1123 -1.7363 3.7202 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3476 -3.3291 1.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3515 -4.0144 1.2997 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3575 -3.3784 4.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8401 -4.9605 3.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3908 -3.6819 3.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1609 -2.1330 -3.6938 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1192 -1.3415 -2.7568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1439 1.9181 -1.7294 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2742 3.8779 0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5226 3.4007 1.3928 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 3.3182 -0.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4166 1.4335 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 1.1759 0.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3051 -0.0996 1.2128 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3648 2.4280 2.7382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7885 1.6168 1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4225 -0.2118 2.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9996 0.5678 3.4638 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9041 0.6842 4.4181 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4302 1.5657 6.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4004 2.2667 5.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2173 2.6884 5.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2166 -1.3489 4.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5409 -0.3007 5.9286 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7924 6.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6318 2.1768 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5866 4.4990 4.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4649 5.3410 2.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0514 4.6710 1.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 5.9964 2.8801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1558 6.3415 5.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6114 7.8711 4.2678 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1009 7.2172 4.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5692 7.9457 1.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2685 8.0196 1.8681 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3857 6.7977 0.7823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5733 3.9859 5.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0746 3.5536 6.7773 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0186 2.1991 6.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8275 3.7771 6.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6961 5.6710 4.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1561 4.7015 4.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7925 5.0019 3.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7289 2.1253 5.0118 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7797 -0.1153 3.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9137 1.2648 4.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8817 -0.2108 4.6108 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5304 1.4645 1.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0545 2.9081 2.5905 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8897 2.2804 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8753 -0.3922 1.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4214 -1.3523 0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0247 -2.0456 -0.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3461 -2.9051 2.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8699 -3.5464 1.6076 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7802 -5.6204 1.5213 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0618 -5.2449 -1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5153 -6.4309 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4722 -7.3536 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9797 -5.6486 -0.5815 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8668 -6.6953 -1.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3695 -7.6115 -1.7643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8711 -9.0397 -1.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2922 -8.6186 -0.6755 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1807 -10.0133 -0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6817 -9.3643 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7718 -9.8284 0.8868 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5874 -8.5161 1.1454 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8294 0.9347 -3.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3704 1.6188 -5.2441 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0356 0.5106 -5.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6997 -0.7110 -5.9408 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7309 -2.1726 -5.4487 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 -1.1846 -6.8866 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2227 -0.5504 -3.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5167 -2.1201 -4.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5483 -1.1436 -5.3403 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 2 0 25 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 12 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 37 40 1 1 40 41 2 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 45 47 1 0 43 48 1 0 48 49 2 0 48 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 51 56 1 0 56 57 2 0 56 58 1 0 58 59 1 0 59 60 1 0 59 61 1 0 59 62 1 6 62 63 2 0 62 64 1 0 64 65 1 0 65 66 1 0 65 67 1 0 65 68 1 6 68 69 2 0 68 70 1 0 70 71 1 0 71 72 1 0 72 73 1 0 73 74 2 0 73 75 1 0 75 76 1 0 76 77 1 0 76 78 1 0 78 79 1 0 79 80 1 0 79 81 1 0 33 82 1 0 82 83 1 0 82 84 1 0 84 85 1 0 84 86 1 0 21 16 1 0 1 87 1 0 1 88 1 0 1 89 1 0 2 90 1 0 2 91 1 0 5 92 1 0 5 93 1 0 6 94 1 6 7 95 1 0 8 96 1 0 8 97 1 0 9 98 1 1 10 99 1 0 10100 1 0 10101 1 0 11102 1 0 11103 1 0 12104 1 1 13105 1 0 16106 1 6 17107 1 0 17108 1 0 18109 1 1 19110 1 0 19111 1 0 19112 1 0 20113 1 0 20114 1 0 24115 1 0 25116 1 0 26117 1 1 27118 1 0 27119 1 0 27120 1 0 28121 1 0 28122 1 0 29123 1 0 29124 1 0 29125 1 0 32126 1 0 33127 1 1 36128 1 0 38129 1 0 38130 1 0 38131 1 0 39132 1 0 39133 1 0 39134 1 0 42135 1 0 43136 1 6 44137 1 0 44138 1 0 45139 1 6 46140 1 0 46141 1 0 46142 1 0 47143 1 0 47144 1 0 47145 1 0 50146 1 0 51147 1 1 52148 1 0 52149 1 0 53150 1 1 54151 1 0 54152 1 0 54153 1 0 55154 1 0 55155 1 0 55156 1 0 58157 1 0 60158 1 0 60159 1 0 60160 1 0 61161 1 0 61162 1 0 61163 1 0 64164 1 0 66165 1 0 66166 1 0 66167 1 0 67168 1 0 67169 1 0 67170 1 0 70171 1 0 71172 1 0 71173 1 0 72174 1 0 72175 1 0 75176 1 0 76177 1 6 77178 1 0 77179 1 0 77180 1 0 78181 1 0 78182 1 0 80183 1 0 80184 1 0 80185 1 0 81186 1 0 81187 1 0 81188 1 0 82189 1 1 83190 1 0 84191 1 6 85192 1 0 85193 1 0 85194 1 0 86195 1 0 86196 1 0 86197 1 0 M END