RDKit 3D 192192 0 0 0 0 0 0 0 0999 V2000 -11.9458 8.5799 -0.8827 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5391 8.4158 -1.3928 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5319 8.2067 -0.2533 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9779 6.9797 0.4772 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1621 6.5339 1.6115 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7602 6.1480 1.4989 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3809 4.9950 0.6121 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5233 5.1748 -0.8292 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3251 4.0103 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1352 3.1858 -1.8115 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4263 2.2215 -2.8419 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6857 2.3633 -0.6206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4731 1.5419 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9344 0.6553 -0.0011 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8845 -0.2767 0.5364 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8968 -1.6536 0.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6708 -2.1144 1.9245 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1326 -2.7791 -0.2333 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6534 -2.3500 -1.5833 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.0525 -1.7411 -1.4307 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7979 -1.5956 -2.3277 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2199 -3.6069 0.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5876 -4.8893 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 -5.0996 -0.2558 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6758 -6.0948 -0.0619 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0918 -6.1249 -1.4118 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5612 -7.5136 -1.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1651 -5.9541 -2.3679 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8513 -6.1835 1.0979 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5159 -6.0798 1.3864 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1893 -4.8946 1.9051 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -6.9434 1.2748 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3107 -8.2251 2.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3478 -9.2332 1.6675 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3837 -9.6328 0.3366 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6932 -9.0374 2.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8204 -9.3331 1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -8.6157 3.3712 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 -6.2059 1.7527 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2424 -5.5333 0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0621 -4.3216 1.1871 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3961 -6.0997 -0.2908 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6683 -7.5759 -0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -5.4013 -0.7226 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3852 -4.4993 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4906 -3.3207 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1415 -4.6729 1.2052 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4192 -5.4712 1.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1254 -6.8650 0.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7064 -7.8825 1.5006 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -7.1247 -0.5883 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3919 -3.4940 1.9913 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3323 -2.1483 1.6771 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4258 -1.4710 2.3205 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1014 -1.3030 0.7418 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1578 -0.6001 1.5747 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 -1.6383 2.1872 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1871 -2.0598 1.4804 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7861 -2.1752 3.3016 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2291 -0.3564 0.0616 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3854 0.3599 -1.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5702 0.2331 -2.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 1.3614 -1.3847 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1303 0.9999 -2.6975 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 1.7977 -3.1282 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0108 3.2467 -3.2709 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 4.0075 -3.7602 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3595 3.8176 -2.8007 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 4.3012 -1.4045 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2432 4.0394 -0.5548 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9667 4.4929 0.8438 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6775 5.8356 0.9318 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1075 4.1132 1.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3795 4.7644 1.2936 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5567 4.4305 2.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8261 5.0901 1.6708 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1849 4.6527 0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8253 2.6582 -1.5469 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 3.5513 -0.4838 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5523 4.7818 -0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 3.1431 0.9132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8314 3.0848 1.2463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9989 3.1666 0.0556 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3421 2.7667 -0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0545 3.2202 -0.9677 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0153 1.8435 0.9213 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3584 2.3329 1.1629 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5427 1.5975 1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 1.7116 2.0554 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5060 9.2001 -1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9605 9.0222 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4130 7.5705 -0.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5024 7.5948 -2.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2600 9.3761 -1.9045 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5490 8.0840 -0.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6095 9.1313 0.3723 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0059 7.3314 0.9455 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3329 6.2246 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7039 5.6150 2.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3001 7.2545 2.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0767 7.0147 1.2251 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3801 5.8999 2.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2757 4.8137 0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8944 4.0768 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4356 5.7569 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6956 5.9494 -1.1208 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6309 4.3867 -2.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2263 3.2936 -1.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2903 3.7896 -2.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6547 2.1782 -3.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4658 1.6434 -0.3381 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3859 2.9967 0.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7023 2.2753 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8065 0.9867 -1.9658 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9869 0.1625 -0.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7745 0.2346 0.9209 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -3.3718 -0.3891 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8405 -3.2873 -2.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4041 -1.2717 -2.3496 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8055 -2.5576 -1.2055 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0839 -1.1022 -0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1442 -2.1962 -2.7931 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7733 -3.0981 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3909 -7.0118 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3633 -5.3553 -1.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7312 -7.6647 -2.9214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5131 -7.6082 -1.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1518 -8.2626 -1.2638 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8336 -6.6612 -2.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4874 -6.3427 1.9975 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1827 -7.1422 0.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2938 -8.0361 3.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3123 -8.7549 1.8724 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -10.2476 2.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4968 -9.4758 -0.1172 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8048 -9.1269 1.6758 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7259 -9.7969 0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0084 -6.2198 2.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3988 -6.0539 -1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5774 -7.7823 -0.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1596 -8.2071 -0.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9587 -7.7953 0.9119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8574 -5.6304 -1.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4689 -5.3870 1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 -5.5440 2.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0897 -4.9412 0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8149 -8.8682 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2769 -7.6045 2.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6578 -3.7691 3.0251 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6803 -1.8857 0.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8292 0.0471 1.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6273 -0.0983 2.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8645 -1.3263 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3325 -3.0740 1.3493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2946 -0.2201 0.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2021 1.4898 -0.6023 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 0.9501 -3.4809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4109 -0.0991 -2.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1996 1.6043 -2.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5948 1.4258 -4.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7164 3.7113 -2.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2504 3.4005 -4.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9205 5.0610 -3.8338 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5028 3.5772 -4.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7351 2.7958 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2077 4.5096 -3.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2093 3.6590 -0.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7028 5.3410 -1.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0544 4.5956 -1.0522 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4566 2.9489 -0.6021 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0456 3.9529 1.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1868 6.2700 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8328 4.4878 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1760 3.0122 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5932 4.5094 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2137 5.8759 1.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6845 3.3523 2.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3619 4.9022 3.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6480 4.8387 2.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6322 6.1878 1.6344 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5026 3.9221 -0.1627 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1935 4.1689 0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3387 5.5449 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5286 2.8917 -2.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 3.9517 1.5805 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8474 2.2290 1.2257 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5071 3.8987 1.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6504 2.1251 1.7819 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4798 3.5620 -0.8101 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4801 1.8111 1.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9828 0.8092 0.5294 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4059 3.3730 1.3955 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 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 18 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 25 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 2 0 32 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 47 52 1 0 52 53 1 0 53 54 2 0 53 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 57 59 2 0 55 60 1 0 60 61 1 0 61 62 2 0 61 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 69 70 1 0 70 71 1 0 71 72 1 0 71 73 1 0 73 74 1 0 74 75 1 0 75 76 1 0 76 77 1 0 63 78 1 0 78 79 1 0 79 80 2 0 79 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 2 0 84 86 1 0 86 87 1 0 87 88 1 0 88 89 2 0 88 14 1 0 1 90 1 0 1 91 1 0 1 92 1 0 2 93 1 0 2 94 1 0 3 95 1 0 3 96 1 0 4 97 1 0 4 98 1 0 5 99 1 0 5100 1 0 6101 1 0 6102 1 0 7103 1 0 7104 1 0 8105 1 0 8106 1 0 9107 1 0 9108 1 0 10109 1 6 11110 1 0 12111 1 0 12112 1 0 13113 1 0 13114 1 0 14115 1 6 15116 1 0 18117 1 6 19118 1 6 20119 1 0 20120 1 0 20121 1 0 21122 1 0 22123 1 0 25124 1 6 26125 1 1 27126 1 0 27127 1 0 27128 1 0 28129 1 0 29130 1 0 32131 1 6 33132 1 0 33133 1 0 34134 1 1 35135 1 0 37136 1 0 37137 1 0 39138 1 0 42139 1 6 43140 1 0 43141 1 0 43142 1 0 44143 1 0 47144 1 1 48145 1 0 48146 1 0 50147 1 0 50148 1 0 52149 1 0 55150 1 6 56151 1 0 56152 1 0 58153 1 0 58154 1 0 60155 1 0 63156 1 1 64157 1 0 64158 1 0 65159 1 0 65160 1 0 66161 1 0 66162 1 0 67163 1 0 67164 1 0 68165 1 0 68166 1 0 69167 1 0 69168 1 0 70169 1 0 70170 1 0 71171 1 1 72172 1 0 73173 1 0 73174 1 0 74175 1 0 74176 1 0 75177 1 0 75178 1 0 76179 1 0 76180 1 0 77181 1 0 77182 1 0 77183 1 0 78184 1 0 81185 1 0 81186 1 0 82187 1 0 82188 1 0 83189 1 0 86190 1 0 86191 1 0 87192 1 0 M END