RDKit 3D 193203 0 0 0 0 0 0 0 0999 V2000 7.7492 -2.7111 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -1.8331 -0.3147 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4543 -2.5673 0.2132 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2589 -1.8769 -0.1064 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2023 -2.7360 0.1725 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6723 -3.2120 -0.9884 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2205 -3.0659 -1.2357 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5512 -1.9479 -0.7823 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5243 -2.0536 0.0744 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8186 -3.2355 0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3199 -0.8767 0.5791 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3481 -0.2477 1.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7351 0.5675 0.9512 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0854 1.8315 0.3977 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1528 2.8541 1.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8028 2.3863 -0.7899 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3412 1.4947 0.1485 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5036 0.1060 -0.5154 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8520 0.0682 -1.1806 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0966 0.9919 -2.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4197 1.0669 -2.8132 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4096 0.7985 -1.6560 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7828 1.2835 -1.8929 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.7786 1.9603 -3.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9936 2.4558 -0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3535 3.0583 -1.0908 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3377 2.0115 -0.6078 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.6168 2.5023 -0.5267 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1690 2.6193 0.7343 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.5183 3.9744 0.8483 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1092 4.3257 2.0235 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.3907 5.3915 2.7521 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3377 5.8700 2.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8852 5.8597 3.9477 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3893 3.1233 2.8947 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.2423 3.4987 3.9522 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2174 2.1408 2.0523 C 0 0 2 0 0 0 0 0 0 0 0 0 -13.4085 1.0114 2.8325 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4528 1.8233 0.7618 C 0 0 1 0 0 0 0 0 0 0 0 0 -13.2730 2.1625 -0.3253 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2565 0.8209 -1.4977 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.0293 1.0882 -2.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1035 -0.2743 -0.8177 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8881 0.2894 -1.7832 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6224 -0.8653 -0.8989 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2468 -1.0767 -0.3945 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -0.6766 -1.3893 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4147 -1.4844 -2.6594 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8532 -0.9622 -0.8401 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4744 -2.3704 -1.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8749 -0.9620 0.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5565 -1.2540 1.3071 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4254 -2.5956 1.7444 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0353 -3.2522 -2.6261 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3106 -4.5695 -2.9269 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7802 -4.9210 -2.6983 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6339 -4.1313 -3.4309 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9635 -4.7058 -1.1710 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1582 -5.1517 -0.7289 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0111 -6.3173 0.0612 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5604 -7.4078 -0.6163 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -8.5012 0.1676 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5347 -9.1003 0.6468 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7692 -8.2482 1.3164 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2458 -8.9272 2.4351 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8556 -6.7995 1.6754 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8295 -6.1944 0.9234 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4819 -6.1959 1.4576 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4828 -4.9068 1.9044 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2041 -0.5508 0.5564 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0343 0.4398 -0.4399 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4714 -0.2047 1.2951 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5176 1.1933 1.3984 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7201 -0.6402 0.6190 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3936 0.3185 -0.1003 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6852 0.4851 0.3720 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6242 -0.0159 -0.5413 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5553 0.9114 -0.9404 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8942 2.1826 -1.4333 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8336 2.9805 -2.0603 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3269 2.8582 -0.1851 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3664 3.6598 0.2932 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1127 5.0172 0.1864 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0684 5.5031 -0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9231 6.8430 -1.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3154 7.6065 0.2514 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6637 7.4209 0.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4588 7.1927 1.4071 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1310 7.5911 2.5857 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2479 5.7056 1.5042 C 0 0 2 0 0 0 0 0 0 0 0 0 11.2220 5.0927 2.3019 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9735 1.8560 0.8637 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9630 1.7989 1.8598 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2997 -2.4814 0.6931 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4264 -2.5202 -1.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4159 -3.7640 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3324 -1.4958 -1.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3225 -1.7704 -1.2215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2037 -2.7505 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7278 -3.9884 -0.7952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8954 0.3153 2.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1764 -1.0752 2.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2557 0.0031 0.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4538 0.8338 1.7664 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 2.3641 2.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8226 3.3916 1.5953 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9927 3.5495 1.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0634 2.6466 -1.5709 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5911 1.7091 -1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3288 3.3521 -0.5338 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 2.2310 -0.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9395 1.4835 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7503 -0.0346 -1.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3461 1.7310 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3943 0.2997 -3.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5069 2.0875 -3.1753 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9271 1.3010 -0.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2719 1.3596 -4.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7998 2.1489 -3.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3317 2.9700 -3.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2386 3.2193 -1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7795 2.1477 0.1209 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4725 3.3497 -2.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4122 3.9350 -0.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9989 1.7389 0.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5324 2.2847 1.5498 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1314 4.7433 1.7444 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8027 6.3310 3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5083 2.6589 3.3344 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0760 3.8387 3.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1733 2.6568 1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6564 1.3035 3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3171 0.7388 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6486 1.3469 -0.7765 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5679 0.5491 -3.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0697 0.7047 -2.7595 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1334 2.1818 -2.9658 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8571 -1.2800 -1.1679 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1419 -0.1398 0.2809 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1869 -0.1490 -1.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0096 -0.1219 -2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9320 -1.8269 -1.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2795 -0.8760 0.0253 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1039 -2.1861 -0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1445 -0.5707 0.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4241 -1.6795 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0433 -2.3756 -2.4866 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9581 -0.9337 -3.4645 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2597 -3.0110 -0.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3508 -2.9436 -1.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5799 -2.4011 -1.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2235 0.0432 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5694 -1.7675 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -0.6977 2.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7635 -2.6170 2.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9909 -4.8630 -3.9319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7534 -5.1960 -2.1779 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9056 -5.9746 -2.9338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5528 -4.3638 -3.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0834 -5.2586 -0.7536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9115 -6.5206 0.0731 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3439 -9.3093 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4422 -10.1455 0.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4411 -9.1056 1.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7012 -8.5487 0.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7675 -8.7008 1.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3368 -9.9023 2.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1266 -6.7133 2.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2306 -6.7687 0.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7613 -6.7687 2.1113 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3624 -4.5968 2.2409 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3671 -0.4734 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2319 1.3294 -0.0715 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3711 -0.6554 2.3154 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6334 1.4917 2.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3970 -1.0539 1.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7967 -0.2062 1.2621 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2729 1.1236 -0.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1279 0.5040 -1.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1136 1.9083 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7411 2.6154 -1.9313 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4634 3.4417 -0.5461 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1167 5.2129 -0.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8901 7.0511 -1.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6598 7.0933 -1.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1411 8.6793 0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0177 6.5564 0.2162 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4916 7.7429 1.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1148 7.5404 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2731 5.5727 2.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 5.4721 3.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0479 2.2273 1.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8016 1.0043 2.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 63 62 1 0 62 61 1 0 61 60 1 0 60 59 1 0 59 58 1 0 58 56 1 0 56 57 1 0 56 55 1 0 55 54 1 0 54 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 11 9 1 6 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 1 14 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 6 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 31 32 1 0 32 34 1 0 32 33 2 0 27 41 1 0 41 42 1 6 41 43 1 0 41 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 6 47 49 1 0 49 50 1 6 49 51 1 0 51 52 1 0 52 53 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 1 0 2 74 1 0 74 75 1 0 75 76 1 0 76 77 1 0 77 78 1 0 78 79 1 0 79 80 1 0 79 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 85 86 1 0 86 87 1 0 86 88 1 0 88 89 1 0 88 90 1 0 90 91 1 0 81 92 1 0 92 93 1 0 74 72 1 0 72 73 1 0 72 70 1 0 70 71 1 0 60 68 1 0 68 69 1 0 68 66 1 0 66 67 1 0 66 64 1 0 64 65 1 0 64 62 1 0 6 58 1 0 70 4 1 0 18 11 1 0 49 19 1 0 92 76 1 0 52 11 1 0 90 83 1 0 47 22 1 0 44 23 1 0 39 29 1 0 63163 1 0 63164 1 0 63165 1 0 62162 1 6 60161 1 1 58160 1 1 56158 1 1 57159 1 0 55156 1 0 55157 1 0 7100 1 1 12101 1 0 12102 1 0 13103 1 0 13104 1 0 15105 1 0 15106 1 0 15107 1 0 16108 1 0 16109 1 0 16110 1 0 17111 1 0 17112 1 0 18113 1 6 20114 1 0 21115 1 0 21116 1 0 22117 1 1 24118 1 0 24119 1 0 24120 1 0 25121 1 0 25122 1 0 26123 1 0 26124 1 0 27125 1 1 29126 1 1 31127 1 6 35129 1 1 36130 1 0 37131 1 6 38132 1 0 39133 1 1 40134 1 0 34128 1 0 42135 1 0 42136 1 0 42137 1 0 43138 1 0 43139 1 0 43140 1 0 44141 1 6 45142 1 0 45143 1 0 46144 1 0 46145 1 0 48146 1 0 48147 1 0 48148 1 0 50149 1 0 50150 1 0 50151 1 0 51152 1 0 51153 1 0 52154 1 1 53155 1 0 6 99 1 6 4 98 1 6 2 97 1 6 1 94 1 0 1 95 1 0 1 96 1 0 74176 1 1 76177 1 1 78178 1 0 78179 1 0 79180 1 6 80181 1 0 81182 1 6 83183 1 6 85184 1 0 85185 1 0 86186 1 6 87187 1 0 88188 1 6 89189 1 0 90190 1 1 91191 1 0 92192 1 1 93193 1 0 72174 1 1 73175 1 0 70172 1 1 71173 1 0 68170 1 1 69171 1 0 66168 1 1 67169 1 0 64166 1 6 65167 1 0 M END