RDKit 3D 202203 0 0 0 0 0 0 0 0999 V2000 -18.5605 -2.9333 -1.1549 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7204 -2.0046 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3248 -0.6364 -0.7937 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.0725 -0.8435 0.6571 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6942 0.3983 1.3715 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3737 0.9596 0.7698 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9929 2.1889 1.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8620 3.0175 1.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5031 2.4284 1.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3538 1.4495 -0.0764 C 0 0 1 0 0 0 0 0 0 0 0 0 -14.6420 2.2125 -1.2682 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9569 0.9495 -0.3398 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2653 0.2452 0.7606 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.1463 1.1290 1.8344 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0290 -0.1252 0.3839 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6780 -1.4426 0.2691 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4498 -1.4868 -0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8475 -2.8101 -0.8653 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.7540 -3.6805 -1.5191 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2081 -3.5174 0.2547 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.5787 -4.6870 -0.2565 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0651 -2.7587 0.9013 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.6427 -3.6358 1.9472 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8675 -2.6528 -0.0420 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.0632 -1.7979 -1.0923 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6058 -2.4723 0.7045 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5243 -3.4801 1.7134 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -1.1531 1.2794 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1685 0.0012 0.3802 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.3259 0.3067 -0.3474 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7123 1.2882 0.9785 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3962 1.3397 1.6357 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3168 0.4785 2.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2079 1.0413 0.7292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1921 2.0345 -0.3730 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0917 3.3435 0.1551 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0168 1.8039 -1.3433 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1045 0.4605 -1.9485 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 2.2271 -0.6998 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1496 3.6104 -0.3473 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5154 2.1276 -1.4548 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5459 2.9199 -2.7227 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1852 0.7819 -1.5050 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5244 0.2903 -0.2494 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3424 0.7340 -2.4593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4462 1.6565 -2.2156 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3720 1.4317 -3.2995 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3351 1.4305 -1.0177 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0549 0.1354 -1.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1897 2.6581 -0.7831 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9814 2.9562 -1.8675 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8661 2.6887 0.5486 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8777 2.6002 1.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1578 1.9802 0.7161 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4812 2.1469 2.1113 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2888 2.7549 0.0609 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4031 4.1478 0.7084 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6187 2.0874 0.0126 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6387 0.8894 -0.6827 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3279 1.9598 1.2924 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7366 0.8972 2.0236 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7926 1.7204 1.3184 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6943 2.6955 0.7104 C 0 0 2 0 0 0 0 0 0 0 0 0 14.5837 4.1147 1.2402 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1444 2.5749 -0.6876 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9808 1.3713 -1.0546 C 0 0 2 0 0 0 0 0 0 0 0 0 16.2591 1.6150 -2.6066 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2890 0.1039 -1.0569 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6804 -1.0367 -0.4222 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9234 -0.8892 0.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7799 -2.1530 -0.5528 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5289 -1.9484 -1.2433 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9228 -3.3609 -0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9494 -4.4696 -0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7319 -4.3739 -0.4964 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7042 -5.7571 -0.1229 C 0 0 2 0 0 0 0 0 0 0 0 0 13.8477 -6.8194 0.4968 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8229 -5.3619 0.6881 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5985 -6.1986 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0772 -3.9470 0.4693 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1491 -3.4225 0.7757 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7138 -2.4006 -0.1991 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.4608 -3.6495 0.3895 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1161 -2.0482 0.2823 C 0 0 2 0 0 0 0 0 0 0 0 0 -13.8505 -1.6617 -0.8362 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9974 -0.9470 1.3200 C 0 0 2 0 0 0 0 0 0 0 0 0 -14.2053 -0.6597 1.9247 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.4403 -3.6141 -2.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6359 -2.3553 -1.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7230 -3.5296 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.9103 -1.8145 -2.4627 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.6486 -2.3157 -0.8534 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4645 -0.2673 -1.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.2209 -0.0030 -0.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.9911 -1.2621 1.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3030 -1.6374 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.4965 0.1280 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4931 1.1552 1.2849 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4871 1.0582 -0.3047 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6824 0.0809 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8606 1.9115 2.6091 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9206 2.8668 1.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0917 3.4391 0.0522 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8244 3.9924 1.7066 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2607 2.0412 2.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7720 3.2782 0.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0998 0.6768 -0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8466 1.5677 -2.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9647 0.4383 -1.3226 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3511 1.8889 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2101 0.7215 2.7139 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3539 -1.7742 1.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6720 -0.8791 -0.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5909 -0.9532 -1.5582 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0702 -2.6393 -1.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8493 -3.4344 -2.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8641 -3.9079 1.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 -4.6602 -1.2341 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2925 -1.8091 1.3329 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3696 -4.1878 2.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7491 -3.6821 -0.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6964 -2.0648 -1.9546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -2.7195 -0.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3195 -4.3195 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4169 -1.2885 1.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1268 -0.9009 2.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4399 -0.3217 -0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9734 0.7087 0.2886 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8451 2.0721 0.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4777 1.5550 1.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2597 2.3687 2.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4262 0.5345 3.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3565 -0.0014 0.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3146 1.0901 1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1604 1.9980 -0.8996 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7354 3.3588 1.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2157 2.5306 -2.1766 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1714 -0.3816 -1.2884 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3298 0.3763 -2.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2087 0.2750 -2.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3615 1.7103 0.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9036 4.1671 -1.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2437 2.7061 -0.7726 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7335 2.3786 -3.6444 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1702 3.8444 -2.6814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5016 3.3473 -2.8472 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4361 0.0627 -1.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3179 -0.6736 -0.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9649 0.8271 -3.4937 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6979 -0.3290 -2.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 2.7330 -2.2899 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2086 0.5519 -3.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7096 1.3833 -0.0745 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9914 -0.5074 -0.2398 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6109 -0.4716 -1.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1245 0.2684 -1.4629 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4323 3.5046 -0.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 2.2171 -2.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1921 3.8288 0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0610 3.3656 2.4374 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8481 2.8224 1.2913 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9146 1.6081 2.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1802 0.9099 0.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9436 2.8114 2.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0085 2.9722 -0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8300 4.9032 0.1512 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2448 4.1317 1.7833 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4838 4.4345 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2254 2.7926 -0.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8493 0.3518 -0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0650 2.8614 1.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8128 0.0854 1.4461 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9742 0.6922 0.9244 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0467 1.5993 2.4267 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7342 2.4029 1.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8796 4.7217 0.6374 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5709 4.6117 1.1682 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2579 4.1465 2.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8382 3.4566 -0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3192 2.5733 -1.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9852 1.4240 -0.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3133 1.3609 -3.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0262 0.8902 -2.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5676 2.6523 -2.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3557 0.0544 -1.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0260 0.2408 0.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8427 -1.1942 -0.1694 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8115 -1.2914 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6665 -1.9796 -0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0844 -6.0668 -1.1262 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4547 -7.5668 1.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2942 -7.3577 -0.3173 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1356 -6.3850 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0013 -6.6405 2.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4022 -5.6000 2.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1032 -7.0097 1.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7435 -2.5861 -1.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6122 -3.5585 1.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6401 -2.9189 0.7156 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2264 -2.4660 -1.2502 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3385 -1.3585 2.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2590 -0.9958 2.8440 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 1 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 39 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 46 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 54 56 1 0 56 57 1 0 56 58 1 0 58 59 1 0 58 60 1 0 60 61 1 0 60 62 1 0 62 63 1 0 63 64 1 0 63 65 1 0 65 66 1 0 66 67 1 0 66 68 1 0 68 69 2 0 69 70 1 0 69 71 1 0 71 72 1 0 71 73 2 0 73 74 1 0 74 75 2 0 74 76 1 0 76 77 1 0 76 78 1 0 78 79 1 0 78 80 1 0 80 81 2 0 16 82 1 0 82 83 1 0 82 84 1 0 84 85 1 0 84 86 1 0 86 87 1 0 86 13 1 0 80 73 1 0 1 88 1 0 1 89 1 0 1 90 1 0 2 91 1 0 2 92 1 0 3 93 1 0 3 94 1 0 4 95 1 0 4 96 1 0 5 97 1 0 5 98 1 0 6 99 1 0 6100 1 0 7101 1 0 7102 1 0 8103 1 0 8104 1 0 9105 1 0 9106 1 0 10107 1 1 11108 1 0 12109 1 0 12110 1 0 14111 1 0 16112 1 1 17113 1 0 17114 1 0 18115 1 6 19116 1 0 20117 1 1 21118 1 0 22119 1 1 23120 1 0 24121 1 6 25122 1 0 26123 1 6 27124 1 0 28125 1 0 28126 1 0 29127 1 6 30128 1 0 31129 1 0 31130 1 0 32131 1 1 33132 1 0 34133 1 0 34134 1 0 35135 1 6 36136 1 0 37137 1 6 38138 1 0 38139 1 0 38140 1 0 39141 1 1 40142 1 0 41143 1 1 42144 1 0 42145 1 0 42146 1 0 43147 1 6 44148 1 0 45149 1 0 45150 1 0 46151 1 1 47152 1 0 48153 1 1 49154 1 0 49155 1 0 49156 1 0 50157 1 1 51158 1 0 52159 1 1 53160 1 0 53161 1 0 53162 1 0 54163 1 6 55164 1 0 56165 1 6 57166 1 0 57167 1 0 57168 1 0 58169 1 6 59170 1 0 60171 1 1 61172 1 0 62173 1 0 62174 1 0 63175 1 1 64176 1 0 64177 1 0 64178 1 0 65179 1 0 65180 1 0 66181 1 1 67182 1 0 67183 1 0 67184 1 0 68185 1 0 70186 1 0 70187 1 0 70188 1 0 72189 1 0 76190 1 6 77191 1 0 77192 1 0 77193 1 0 79194 1 0 79195 1 0 79196 1 0 82197 1 6 83198 1 0 84199 1 1 85200 1 0 86201 1 1 87202 1 0 M END