RDKit 3D 198208 0 0 0 0 0 0 0 0999 V2000 5.6651 2.1231 -2.6579 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7839 3.3698 -2.6968 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4159 3.0377 -2.9639 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1584 2.4936 -4.2592 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7499 2.5649 -4.5057 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9463 1.7690 -3.6157 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0890 1.0067 -4.4537 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5925 -0.0298 -5.3542 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -0.7239 -6.1214 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0047 0.2934 -3.6173 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7869 1.1616 -2.7930 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6893 0.3606 -2.0239 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7396 -0.1820 -2.8336 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6682 -1.0786 -1.9976 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9563 -2.2741 -1.6424 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7554 -3.2187 -0.9372 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9468 -4.3318 -0.5219 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5961 -5.2253 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -5.2285 -2.6133 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5357 -6.2365 -0.9714 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0912 -7.6683 -1.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7834 -8.2735 -0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8048 -8.4668 1.1588 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1340 -9.8512 1.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6043 -8.4093 2.4747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6999 -7.3744 1.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2094 -6.0547 0.5426 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3094 -4.8594 0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5575 -4.1883 2.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8278 -2.9800 2.5135 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4032 -2.5706 1.6764 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9744 -1.1325 2.0633 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0965 -0.0323 1.8816 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.1521 3.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4108 -0.1024 4.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7175 1.0151 3.0139 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6086 1.9149 2.9147 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7283 3.1216 3.6724 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7429 2.8422 5.0709 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6003 4.0328 5.8437 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2035 4.6431 5.6835 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6252 4.2549 6.7918 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4801 4.2323 4.3597 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2645 3.0500 4.6171 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1477 2.6739 3.5518 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9958 3.7681 3.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8694 3.4418 2.1061 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8275 2.3136 2.4911 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6691 1.9735 1.3837 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0119 1.0991 2.9440 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8718 0.0661 3.4567 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0161 1.4910 4.0384 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2447 0.3292 4.3798 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5716 4.0798 3.2469 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0995 5.4031 2.9995 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6758 5.5472 1.6970 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8128 6.4010 1.8289 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5735 6.5579 0.6234 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7748 5.6218 0.6719 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 6.3781 -0.6583 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3130 7.0711 -1.7707 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3338 6.9329 -0.4040 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5421 6.8547 -1.6029 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 6.1655 0.7313 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2116 5.1408 0.1768 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 0.4504 1.5968 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9107 1.5719 0.5451 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6048 0.0943 1.6434 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0857 -0.3755 0.3891 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2739 -0.8687 1.2282 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0271 -1.0676 -0.2833 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5067 -2.4725 -0.6018 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1955 -2.8535 0.1385 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9350 -1.9626 -0.4455 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1829 -4.4302 -0.0793 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0334 -5.3495 0.2307 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 -4.6946 -1.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2581 -6.0456 -1.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2844 -2.5993 0.3684 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1674 -3.4933 1.0689 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0398 -1.3036 0.0868 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4135 -0.7075 1.3527 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1795 -0.3484 -0.7458 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9625 0.7864 -1.1258 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.9593 -1.8401 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6184 2.9190 -1.0709 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2104 2.6974 -2.6329 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1230 3.2788 -1.6894 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 3.2814 -5.3954 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0101 2.5745 -5.9046 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3513 4.6264 -4.8674 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0614 5.3447 -5.8901 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2942 4.4476 -3.6695 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3682 5.7225 -2.9933 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6691 2.3694 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7656 1.6524 -3.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2317 1.3708 -1.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7854 3.7812 -1.6819 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4628 1.4403 -4.2832 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5688 1.0626 -3.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6613 1.6901 -5.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2952 0.4381 -6.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1294 -0.7769 -4.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0541 -1.0366 -5.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3699 1.8549 -3.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3142 0.6423 -3.2714 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2992 -0.7782 -3.6411 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5106 -1.3613 -2.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5868 -3.5753 -1.5592 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7989 -7.6641 -2.0858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2801 -8.3422 -1.5524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2413 -9.2317 -0.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6146 -7.6161 0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5759 -9.9674 0.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4315 -10.0010 1.8994 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8767 -10.6557 1.1163 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0787 -7.4318 2.6134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3951 -9.1679 2.4884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9569 -8.5885 3.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3347 -7.2123 2.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -7.7335 0.5872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1638 -5.8612 1.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3651 -4.5173 2.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5645 -2.1751 2.5791 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -3.1832 3.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1993 -3.2618 1.9878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 0.5587 2.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -0.4152 1.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1381 0.6569 1.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 -2.1335 3.8227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4897 -1.0613 4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0672 0.3228 4.9638 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3468 -0.6257 4.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5797 1.5790 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6899 3.5841 3.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 4.7461 5.5329 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7942 3.7738 6.8898 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 5.7330 5.7412 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 3.4139 6.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1719 5.0467 4.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 2.3682 2.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4405 4.3401 1.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2826 3.1835 1.2163 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4808 2.6412 3.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2566 1.2504 1.6922 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4798 0.6505 2.0959 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3703 -0.2814 2.6875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5539 1.7799 4.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9072 -0.3604 4.5782 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0975 3.7157 2.3302 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0152 4.5696 1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9682 7.5813 0.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4582 4.5752 0.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3436 5.7800 1.5947 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4434 5.7828 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6655 5.3239 -0.9458 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1244 6.5815 -2.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4093 7.9961 -0.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1291 7.2068 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 6.8485 1.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4681 5.5059 -0.7008 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2905 1.2883 -0.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8636 1.8581 0.4225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4615 2.4688 0.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8029 -0.6814 2.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2002 0.9753 1.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0037 -0.6656 0.5292 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9419 -1.6991 1.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -0.9410 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3394 -0.3137 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3707 -2.5587 -1.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3117 -3.1646 -0.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0213 -2.0622 -1.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7504 -0.9003 -0.3143 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9062 -2.1833 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8536 -5.1929 -0.4767 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7842 -6.4102 0.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -5.2041 1.2417 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3022 -3.9480 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2861 -4.6096 -2.2115 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5028 -6.1123 -2.8875 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5397 -6.8507 -1.6266 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -2.3922 1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6517 -4.3072 1.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9854 -1.5076 -0.4314 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9702 -1.4024 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3402 0.0042 -0.1348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9282 1.4042 -0.3619 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4088 1.2818 -1.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9485 3.4274 -0.5604 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2286 3.5449 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9671 3.4223 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1982 3.4335 -6.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6741 1.8172 -6.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4972 5.2543 -4.5856 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5918 4.6735 -6.3658 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3199 4.2309 -3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6335 6.3567 -3.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 27 26 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 26 1 0 36 37 1 0 38 54 1 0 66 67 1 6 54 43 1 0 32 33 1 1 43 41 1 0 73 74 1 6 41 40 1 0 27122 1 1 40 39 1 0 39 38 1 0 66 68 1 0 41 42 1 0 75 76 1 1 43 44 1 0 54 55 1 0 35 36 1 0 23 24 1 6 62 63 1 0 20 18 1 6 48 49 1 0 31126 1 1 60 61 1 0 18 19 2 0 18 17 1 0 56 55 1 0 70168 1 1 45 44 1 0 45 52 1 0 52 50 1 0 50 48 1 0 48 47 1 0 47 46 1 0 46 45 1 0 50 51 1 0 52 53 1 0 60 62 1 0 62 64 1 0 93 91 1 0 91 89 1 0 89 4 1 0 4 3 1 0 3 2 1 0 2 93 1 0 4 5 1 0 91 92 1 0 64 56 1 0 56 57 1 0 57 58 1 0 58 60 1 0 35 34 1 0 36 66 1 0 66 70 1 0 32 34 1 0 32 70 1 0 32 31 1 0 11 85 1 0 85 87 1 0 87 6 1 0 6 7 1 0 7 10 1 0 10 11 1 0 6 5 1 0 87 88 1 0 85 86 1 0 70 71 1 0 8 9 1 0 71 72 1 0 72 73 1 0 31 73 1 0 31 30 1 0 73 75 1 0 28 29 2 0 29 30 1 0 28 75 1 0 28 27 1 0 75 77 1 0 16 79 1 0 79 81 1 0 81 83 1 0 83 14 1 0 14 15 1 0 15 16 1 0 83 84 1 0 81 82 1 0 79 80 1 0 13 12 1 0 77 78 1 0 64 65 1 0 78 20 1 0 68 69 1 0 27 20 1 0 23 25 1 0 58 59 1 0 38 37 1 0 93 94 1 0 2 1 1 0 89 90 1 0 11 12 1 0 7 8 1 0 14 13 1 0 16 17 1 0 53149 1 0 49145 1 0 51147 1 0 45141 1 6 48144 1 1 50146 1 6 52148 1 1 47142 1 0 47143 1 0 63159 1 0 60156 1 6 56151 1 6 59153 1 0 59154 1 0 59155 1 0 58152 1 6 64160 1 1 62158 1 1 61157 1 0 38135 1 6 41138 1 6 42139 1 0 43140 1 6 54150 1 6 40136 1 0 40137 1 0 35132 1 0 35133 1 0 36134 1 1 34130 1 0 34131 1 0 71169 1 0 71170 1 0 72171 1 0 72172 1 0 29123 1 0 30124 1 0 30125 1 0 77179 1 0 77180 1 0 78181 1 0 78182 1 0 21110 1 0 21111 1 0 22112 1 0 22113 1 0 26120 1 0 26121 1 0 67162 1 0 67163 1 0 67164 1 0 33127 1 0 33128 1 0 33129 1 0 74173 1 0 74174 1 0 74175 1 0 68165 1 0 68166 1 0 76176 1 0 76177 1 0 76178 1 0 24114 1 0 24115 1 0 24116 1 0 92196 1 0 94198 1 0 90194 1 0 93197 1 6 4 99 1 1 1 95 1 0 1 96 1 0 1 97 1 0 2 98 1 1 89193 1 6 91195 1 1 11105 1 6 6100 1 1 87191 1 6 88192 1 0 85189 1 1 86190 1 0 8102 1 0 8103 1 0 7101 1 6 9104 1 0 16109 1 6 83187 1 1 84188 1 0 81185 1 6 82186 1 0 79183 1 1 80184 1 0 13106 1 0 13107 1 0 14108 1 6 65161 1 0 69167 1 0 25117 1 0 25118 1 0 25119 1 0 M END