lig_ejm_31 3D Schrodinger Suite 2021-1. 32 33 0 0 1 0 999 V2000 -4.7726 -2.8276 -16.4990 H 0 0 0 0 0 0 -5.3616 -3.6890 -16.2224 C 0 0 0 0 0 0 -4.7777 -4.9643 -16.1989 C 0 0 0 0 0 0 -5.5357 -6.0885 -15.8273 C 0 0 0 0 0 0 -6.9007 -5.9451 -15.4736 C 0 0 0 0 0 0 -7.4915 -4.6571 -15.5270 C 0 0 0 0 0 0 -6.7187 -3.5398 -15.8968 C 0 0 0 0 0 0 -7.1766 -2.5639 -15.9391 H 0 0 0 0 0 0 -9.1733 -4.4152 -15.1872 Cl 0 0 0 0 0 0 -7.7131 -7.1309 -15.0378 C 0 0 0 0 0 0 -8.1428 -7.1983 -13.8857 O 0 0 0 0 0 0 -7.8973 -8.0563 -15.9972 N 0 0 0 0 0 0 -7.4216 -7.8671 -16.8645 H 0 0 0 0 0 0 -8.7209 -9.2140 -16.0056 C 0 0 0 0 0 0 -9.5775 -9.5988 -14.9513 C 0 0 0 0 0 0 -10.3850 -10.7324 -15.1337 C 0 0 0 0 0 0 -10.3675 -11.4892 -16.2527 N 0 0 0 0 0 0 -9.5395 -11.1490 -17.2696 C 0 0 0 0 0 0 -8.7142 -10.0001 -17.1743 C 0 0 0 0 0 0 -8.0845 -9.6948 -17.9928 H 0 0 0 0 0 0 -9.5744 -11.9335 -18.4562 N 0 0 0 0 0 0 -10.3993 -12.5047 -18.5524 H 0 0 0 0 0 0 -8.6698 -12.0385 -19.4488 C 0 0 0 0 0 0 -7.5795 -11.4706 -19.4776 O 0 0 0 0 0 0 -9.0521 -12.9529 -20.6079 C 0 0 0 0 0 0 -9.1557 -13.9753 -20.2570 H 0 0 0 0 0 0 -8.2854 -12.9378 -21.3838 H 0 0 0 0 0 0 -9.9953 -12.6471 -21.0606 H 0 0 0 0 0 0 -11.0653 -11.0423 -14.3552 H 0 0 0 0 0 0 -9.6624 -9.0406 -14.0311 H 0 0 0 0 0 0 -4.7517 -7.6238 -15.8230 Cl 0 0 0 0 0 0 -3.7337 -5.0777 -16.4531 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 32 1 0 0 0 4 5 2 0 0 0 4 31 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 30 1 0 0 0 16 17 2 0 0 0 16 29 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 25 28 1 0 0 0 M END $$$$ lig_ejm_42 3D Schrodinger Suite 2021-1. 35 36 0 0 1 0 999 V2000 -4.7651 -2.8327 -16.5085 H 0 0 0 0 0 0 -5.3566 -3.6931 -16.2274 C 0 0 0 0 0 0 -4.7703 -4.9699 -16.2000 C 0 0 0 0 0 0 -5.5308 -6.0951 -15.8304 C 0 0 0 0 0 0 -6.8949 -5.9511 -15.4713 C 0 0 0 0 0 0 -7.4890 -4.6634 -15.5282 C 0 0 0 0 0 0 -6.7163 -3.5454 -15.9025 C 0 0 0 0 0 0 -7.1712 -2.5665 -15.9462 H 0 0 0 0 0 0 -9.1723 -4.4253 -15.1881 Cl 0 0 0 0 0 0 -7.7033 -7.1383 -15.0290 C 0 0 0 0 0 0 -8.1063 -7.2116 -13.8677 O 0 0 0 0 0 0 -7.9070 -8.0509 -15.9995 N 0 0 0 0 0 0 -7.4368 -7.8589 -16.8700 H 0 0 0 0 0 0 -8.7273 -9.2093 -16.0054 C 0 0 0 0 0 0 -9.5795 -9.5870 -14.9482 C 0 0 0 0 0 0 -10.3824 -10.7260 -15.1183 C 0 0 0 0 0 0 -10.3697 -11.4927 -16.2307 N 0 0 0 0 0 0 -9.5502 -11.1540 -17.2556 C 0 0 0 0 0 0 -8.7228 -10.0033 -17.1694 C 0 0 0 0 0 0 -8.0991 -9.7012 -17.9932 H 0 0 0 0 0 0 -9.5855 -11.9542 -18.4360 N 0 0 0 0 0 0 -10.4161 -12.5261 -18.5296 H 0 0 0 0 0 0 -8.6860 -12.0792 -19.4324 C 0 0 0 0 0 0 -7.6122 -11.4803 -19.4878 O 0 0 0 0 0 0 -9.0543 -13.0501 -20.5630 C 0 0 0 0 0 0 -9.4460 -12.4644 -21.3945 H 0 0 0 0 0 0 -9.8593 -13.7211 -20.2586 H 0 0 0 0 0 0 -7.8548 -13.8881 -21.0370 C 0 0 0 0 0 0 -8.1521 -14.5653 -21.8378 H 0 0 0 0 0 0 -7.4478 -14.4888 -20.2242 H 0 0 0 0 0 0 -7.0528 -13.2593 -21.4243 H 0 0 0 0 0 0 -11.0595 -11.0334 -14.3357 H 0 0 0 0 0 0 -9.6718 -9.0215 -14.0321 H 0 0 0 0 0 0 -4.7507 -7.6371 -15.8263 Cl 0 0 0 0 0 0 -3.7255 -5.0857 -16.4564 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 35 1 0 0 0 4 5 2 0 0 0 4 34 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 33 1 0 0 0 16 17 2 0 0 0 16 32 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 25 28 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 28 31 1 0 0 0 M END $$$$ lig_ejm_43 3D Schrodinger Suite 2021-1. 38 39 0 0 1 0 999 V2000 -4.7758 -2.7864 -16.4082 H 0 0 0 0 0 0 -5.3657 -3.6568 -16.1610 C 0 0 0 0 0 0 -4.7770 -4.9320 -16.1583 C 0 0 0 0 0 0 -5.5388 -6.0668 -15.8207 C 0 0 0 0 0 0 -6.9087 -5.9356 -15.4763 C 0 0 0 0 0 0 -7.4997 -4.6467 -15.5030 C 0 0 0 0 0 0 -6.7268 -3.5203 -15.8414 C 0 0 0 0 0 0 -7.1830 -2.5426 -15.8586 H 0 0 0 0 0 0 -9.1769 -4.4070 -15.1619 Cl 0 0 0 0 0 0 -7.7202 -7.1315 -15.0648 C 0 0 0 0 0 0 -8.1427 -7.2196 -13.9119 O 0 0 0 0 0 0 -7.9075 -8.0393 -16.0420 N 0 0 0 0 0 0 -7.4294 -7.8412 -16.9085 H 0 0 0 0 0 0 -8.7331 -9.1970 -16.0628 C 0 0 0 0 0 0 -9.5813 -9.5943 -15.0077 C 0 0 0 0 0 0 -10.3875 -10.7275 -15.1925 C 0 0 0 0 0 0 -10.3747 -11.4776 -16.3137 N 0 0 0 0 0 0 -9.5525 -11.1298 -17.3300 C 0 0 0 0 0 0 -8.7317 -9.9757 -17.2380 C 0 0 0 0 0 0 -8.1078 -9.6660 -18.0619 H 0 0 0 0 0 0 -9.5769 -11.9365 -18.5018 N 0 0 0 0 0 0 -10.4090 -12.5045 -18.5971 H 0 0 0 0 0 0 -8.6442 -12.0954 -19.4628 C 0 0 0 0 0 0 -7.5769 -11.4851 -19.5059 O 0 0 0 0 0 0 -8.9538 -13.1242 -20.5645 C 0 0 0 0 0 0 -9.8786 -13.6562 -20.3326 H 0 0 0 0 0 0 -7.8024 -14.1443 -20.7182 C 0 0 0 0 0 0 -7.5769 -14.7000 -19.8218 H 0 0 0 0 0 0 -6.8777 -13.6545 -21.0281 H 0 0 0 0 0 0 -8.0460 -14.8838 -21.4813 H 0 0 0 0 0 0 -9.0660 -12.4773 -21.9486 C 0 0 0 0 0 0 -9.9769 -11.9211 -22.0282 H 0 0 0 0 0 0 -8.2320 -11.8090 -22.1675 H 0 0 0 0 0 0 -9.1067 -13.2257 -22.7407 H 0 0 0 0 0 0 -11.0613 -11.0504 -14.4126 H 0 0 0 0 0 0 -9.6587 -9.0508 -14.0795 H 0 0 0 0 0 0 -4.7498 -7.6003 -15.8230 Cl 0 0 0 0 0 0 -3.7302 -5.0379 -16.4049 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 38 1 0 0 0 4 5 2 0 0 0 4 37 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 36 1 0 0 0 16 17 2 0 0 0 16 35 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 25 31 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 27 30 1 0 0 0 31 32 1 0 0 0 31 33 1 0 0 0 31 34 1 0 0 0 M END $$$$ lig_ejm_46 3D Schrodinger Suite 2021-1. 36 38 0 0 1 0 999 V2000 -4.7642 -2.8405 -16.5095 H 0 0 0 0 0 0 -5.3549 -3.7036 -16.2280 C 0 0 0 0 0 0 -4.7655 -4.9789 -16.1978 C 0 0 0 0 0 0 -5.5250 -6.1059 -15.8276 C 0 0 0 0 0 0 -6.8908 -5.9630 -15.4706 C 0 0 0 0 0 0 -7.4868 -4.6765 -15.5285 C 0 0 0 0 0 0 -6.7155 -3.5576 -15.9050 C 0 0 0 0 0 0 -7.1711 -2.5800 -15.9497 H 0 0 0 0 0 0 -9.1671 -4.4347 -15.1879 Cl 0 0 0 0 0 0 -7.7019 -7.1485 -15.0306 C 0 0 0 0 0 0 -8.1203 -7.2180 -13.8734 O 0 0 0 0 0 0 -7.9020 -8.0626 -15.9990 N 0 0 0 0 0 0 -7.4296 -7.8726 -16.8697 H 0 0 0 0 0 0 -8.7245 -9.2193 -16.0067 C 0 0 0 0 0 0 -9.5810 -9.6038 -14.9544 C 0 0 0 0 0 0 -10.3869 -10.7402 -15.1394 C 0 0 0 0 0 0 -10.3684 -11.4988 -16.2561 N 0 0 0 0 0 0 -9.5411 -11.1531 -17.2713 C 0 0 0 0 0 0 -8.7144 -10.0045 -17.1736 C 0 0 0 0 0 0 -8.0887 -9.6938 -17.9918 H 0 0 0 0 0 0 -9.5589 -11.9408 -18.4576 N 0 0 0 0 0 0 -10.3650 -12.5441 -18.5562 H 0 0 0 0 0 0 -8.6360 -12.0467 -19.4396 C 0 0 0 0 0 0 -7.5689 -11.4309 -19.4796 O 0 0 0 0 0 0 -9.0181 -13.0160 -20.5102 C 0 0 0 0 0 0 -8.6057 -12.7169 -21.9357 C 0 0 0 0 0 0 -7.9060 -13.8101 -21.1676 C 0 0 0 0 0 0 -8.1255 -14.8406 -21.4327 H 0 0 0 0 0 0 -6.8762 -13.6193 -20.8697 H 0 0 0 0 0 0 -8.0355 -11.8125 -22.1402 H 0 0 0 0 0 0 -9.3172 -12.9932 -22.7102 H 0 0 0 0 0 0 -9.9736 -13.5213 -20.3895 H 0 0 0 0 0 0 -11.0748 -11.0441 -14.3639 H 0 0 0 0 0 0 -9.6684 -9.0431 -14.0367 H 0 0 0 0 0 0 -4.7380 -7.6418 -15.8227 Cl 0 0 0 0 0 0 -3.7213 -5.0916 -16.4542 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 36 1 0 0 0 4 5 2 0 0 0 4 35 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 34 1 0 0 0 16 17 2 0 0 0 16 33 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 27 1 0 0 0 25 26 1 0 0 0 25 32 1 0 0 0 26 27 1 0 0 0 26 30 1 0 0 0 26 31 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 M END $$$$ lig_ejm_47 3D Schrodinger Suite 2021-1. 39 41 0 0 1 0 999 V2000 -4.7710 -2.7958 -16.4978 H 0 0 0 0 0 0 -5.3622 -3.6601 -16.2251 C 0 0 0 0 0 0 -6.7228 -3.5154 -15.9047 C 0 0 0 0 0 0 -7.4990 -4.6316 -15.5395 C 0 0 0 0 0 0 -6.9098 -5.9210 -15.4840 C 0 0 0 0 0 0 -5.5411 -6.0619 -15.8372 C 0 0 0 0 0 0 -4.7773 -4.9364 -16.1997 C 0 0 0 0 0 0 -3.7298 -5.0464 -16.4444 H 0 0 0 0 0 0 -4.7493 -7.5935 -15.8222 Cl 0 0 0 0 0 0 -7.7221 -7.1086 -15.0399 C 0 0 0 0 0 0 -8.1200 -7.1967 -13.8766 O 0 0 0 0 0 0 -7.9177 -8.0239 -16.0075 N 0 0 0 0 0 0 -7.4448 -7.8335 -16.8781 H 0 0 0 0 0 0 -8.7460 -9.1777 -16.0235 C 0 0 0 0 0 0 -9.5772 -9.5870 -14.9614 C 0 0 0 0 0 0 -10.3788 -10.7255 -15.1522 C 0 0 0 0 0 0 -10.3750 -11.4658 -16.2840 N 0 0 0 0 0 0 -9.5645 -11.1035 -17.3073 C 0 0 0 0 0 0 -8.7559 -9.9418 -17.2069 C 0 0 0 0 0 0 -8.1406 -9.6119 -18.0290 H 0 0 0 0 0 0 -9.5782 -11.8937 -18.4963 N 0 0 0 0 0 0 -10.4038 -12.4664 -18.6054 H 0 0 0 0 0 0 -8.6353 -12.0193 -19.4573 C 0 0 0 0 0 0 -7.5764 -11.3926 -19.4774 O 0 0 0 0 0 0 -8.9229 -13.0284 -20.5859 C 0 0 0 0 0 0 -8.6756 -12.5134 -22.0198 C 0 0 0 0 0 0 -8.0186 -13.8555 -22.3469 C 0 0 0 0 0 0 -7.7694 -14.0202 -20.8465 C 0 0 0 0 0 0 -7.9493 -15.0312 -20.4860 H 0 0 0 0 0 0 -6.7826 -13.6664 -20.5416 H 0 0 0 0 0 0 -7.1203 -13.7980 -22.9633 H 0 0 0 0 0 0 -8.7315 -14.5837 -22.7394 H 0 0 0 0 0 0 -7.9803 -11.6755 -22.0897 H 0 0 0 0 0 0 -9.5770 -12.3187 -22.5983 H 0 0 0 0 0 0 -9.8902 -13.5295 -20.4978 H 0 0 0 0 0 0 -11.0408 -11.0611 -14.3663 H 0 0 0 0 0 0 -9.6397 -9.0467 -14.0281 H 0 0 0 0 0 0 -9.1773 -4.3783 -15.2060 Cl 0 0 0 0 0 0 -7.1757 -2.5362 -15.9443 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 39 1 0 0 0 4 5 2 0 0 0 4 38 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 37 1 0 0 0 16 17 2 0 0 0 16 36 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 28 1 0 0 0 25 26 1 0 0 0 25 35 1 0 0 0 26 27 1 0 0 0 26 33 1 0 0 0 26 34 1 0 0 0 27 28 1 0 0 0 27 31 1 0 0 0 27 32 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 M END $$$$ lig_ejm_48 3D Schrodinger Suite 2021-1. 42 44 0 0 1 0 999 V2000 -4.7806 -2.7772 -16.4434 H 0 0 0 0 0 0 -5.3676 -3.6465 -16.1852 C 0 0 0 0 0 0 -4.7769 -4.9205 -16.1714 C 0 0 0 0 0 0 -5.5376 -6.0528 -15.8227 C 0 0 0 0 0 0 -6.9070 -5.9191 -15.4756 C 0 0 0 0 0 0 -7.4992 -4.6314 -15.5128 C 0 0 0 0 0 0 -6.7276 -3.5087 -15.8630 C 0 0 0 0 0 0 -7.1848 -2.5317 -15.8892 H 0 0 0 0 0 0 -9.1769 -4.3893 -15.1746 Cl 0 0 0 0 0 0 -7.7212 -7.1103 -15.0571 C 0 0 0 0 0 0 -8.1393 -7.1981 -13.9030 O 0 0 0 0 0 0 -7.9218 -8.0129 -16.0346 N 0 0 0 0 0 0 -7.4512 -7.8119 -16.9045 H 0 0 0 0 0 0 -8.7481 -9.1686 -16.0525 C 0 0 0 0 0 0 -9.5798 -9.5825 -14.9913 C 0 0 0 0 0 0 -10.3775 -10.7221 -15.1791 C 0 0 0 0 0 0 -10.3682 -11.4628 -16.3069 N 0 0 0 0 0 0 -9.5623 -11.0966 -17.3301 C 0 0 0 0 0 0 -8.7569 -9.9317 -17.2354 C 0 0 0 0 0 0 -8.1457 -9.5990 -18.0592 H 0 0 0 0 0 0 -9.5769 -11.9004 -18.5054 N 0 0 0 0 0 0 -10.3792 -12.5129 -18.5798 H 0 0 0 0 0 0 -8.6637 -12.0054 -19.4887 C 0 0 0 0 0 0 -7.6404 -11.3231 -19.5605 O 0 0 0 0 0 0 -8.9216 -13.0751 -20.5678 C 0 0 0 0 0 0 -8.9524 -12.4999 -21.9980 C 0 0 0 0 0 0 -8.2926 -13.5073 -22.9488 C 0 0 0 0 0 0 -7.7436 -14.6222 -22.0660 C 0 0 0 0 0 0 -7.6746 -13.9986 -20.6761 C 0 0 0 0 0 0 -7.5769 -14.7512 -19.8963 H 0 0 0 0 0 0 -6.7547 -13.4133 -20.6284 H 0 0 0 0 0 0 -6.7769 -14.9877 -22.4122 H 0 0 0 0 0 0 -8.4370 -15.4622 -22.0644 H 0 0 0 0 0 0 -7.4882 -13.0244 -23.5058 H 0 0 0 0 0 0 -9.0044 -13.8985 -23.6767 H 0 0 0 0 0 0 -8.4190 -11.5446 -22.0668 H 0 0 0 0 0 0 -9.9768 -12.3220 -22.3078 H 0 0 0 0 0 0 -9.8199 -13.6608 -20.3658 H 0 0 0 0 0 0 -11.0370 -11.0599 -14.3932 H 0 0 0 0 0 0 -9.6473 -9.0490 -14.0569 H 0 0 0 0 0 0 -4.7462 -7.5852 -15.8223 Cl 0 0 0 0 0 0 -3.7312 -5.0277 -16.4208 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 42 1 0 0 0 4 5 2 0 0 0 4 41 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 40 1 0 0 0 16 17 2 0 0 0 16 39 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 29 1 0 0 0 25 26 1 0 0 0 25 38 1 0 0 0 26 27 1 0 0 0 26 36 1 0 0 0 26 37 1 0 0 0 27 28 1 0 0 0 27 34 1 0 0 0 27 35 1 0 0 0 28 29 1 0 0 0 28 32 1 0 0 0 28 33 1 0 0 0 29 30 1 0 0 0 29 31 1 0 0 0 M END $$$$ lig_ejm_50 3D Schrodinger Suite 2021-1. 33 34 0 0 1 0 999 V2000 -4.7971 -2.7828 -16.4669 H 0 0 0 0 0 0 -5.3788 -3.6540 -16.2032 C 0 0 0 0 0 0 -4.7842 -4.9254 -16.1895 C 0 0 0 0 0 0 -5.5365 -6.0583 -15.8239 C 0 0 0 0 0 0 -6.9024 -5.9288 -15.4613 C 0 0 0 0 0 0 -7.4999 -4.6438 -15.5003 C 0 0 0 0 0 0 -6.7356 -3.5208 -15.8669 C 0 0 0 0 0 0 -7.1930 -2.5443 -15.8928 H 0 0 0 0 0 0 -9.1769 -4.4052 -15.1506 Cl 0 0 0 0 0 0 -7.7083 -7.1203 -15.0262 C 0 0 0 0 0 0 -8.1436 -7.1856 -13.8767 O 0 0 0 0 0 0 -7.8838 -8.0479 -15.9847 N 0 0 0 0 0 0 -7.4002 -7.8655 -16.8511 H 0 0 0 0 0 0 -8.7100 -9.2031 -15.9928 C 0 0 0 0 0 0 -9.5717 -9.5861 -14.9420 C 0 0 0 0 0 0 -10.3774 -10.7205 -15.1209 C 0 0 0 0 0 0 -10.3600 -11.4760 -16.2385 N 0 0 0 0 0 0 -9.5290 -11.1353 -17.2521 C 0 0 0 0 0 0 -8.6974 -9.9916 -17.1601 C 0 0 0 0 0 0 -8.0618 -9.6948 -17.9809 H 0 0 0 0 0 0 -9.5770 -11.9206 -18.4322 N 0 0 0 0 0 0 -10.4274 -12.4608 -18.5322 H 0 0 0 0 0 0 -8.6810 -12.0611 -19.4286 C 0 0 0 0 0 0 -7.5776 -11.5115 -19.4762 O 0 0 0 0 0 0 -9.1224 -12.9805 -20.5744 C 0 0 0 0 0 0 -9.3530 -12.3758 -21.4514 H 0 0 0 0 0 0 -10.0327 -13.5198 -20.3069 H 0 0 0 0 0 0 -8.1134 -13.9200 -20.8980 O 0 0 0 0 0 0 -8.4590 -14.4776 -21.5795 H 0 0 0 0 0 0 -11.0554 -11.0362 -14.3423 H 0 0 0 0 0 0 -9.6558 -9.0323 -14.0202 H 0 0 0 0 0 0 -4.7358 -7.5856 -15.8221 Cl 0 0 0 0 0 0 -3.7408 -5.0305 -16.4513 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 33 1 0 0 0 4 5 2 0 0 0 4 32 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 31 1 0 0 0 16 17 2 0 0 0 16 30 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 25 28 1 0 0 0 28 29 1 0 0 0 M END $$$$ lig_jmc_23 3D Schrodinger Suite 2021-1. 36 38 0 0 1 0 999 V2000 -4.7871 -2.7885 -16.4970 H 0 0 0 0 0 0 -5.3697 -3.6577 -16.2217 C 0 0 0 0 0 0 -4.7769 -4.9309 -16.1922 C 0 0 0 0 0 0 -5.5340 -6.0593 -15.8230 C 0 0 0 0 0 0 -6.9023 -5.9231 -15.4705 C 0 0 0 0 0 0 -7.4977 -4.6364 -15.5270 C 0 0 0 0 0 0 -6.7277 -3.5164 -15.8967 C 0 0 0 0 0 0 -7.1783 -2.5375 -15.9389 H 0 0 0 0 0 0 -9.1769 -4.3939 -15.1975 Cl 0 0 0 0 0 0 -7.7122 -7.1118 -15.0366 C 0 0 0 0 0 0 -8.1396 -7.1851 -13.8839 O 0 0 0 0 0 0 -7.9032 -8.0308 -15.9995 N 0 0 0 0 0 0 -7.4257 -7.8484 -16.8690 H 0 0 0 0 0 0 -8.7261 -9.1875 -16.0036 C 0 0 0 0 0 0 -9.5483 -9.5964 -14.9328 C 0 0 0 0 0 0 -10.3511 -10.7349 -15.1078 C 0 0 0 0 0 0 -10.3507 -11.4835 -16.2324 N 0 0 0 0 0 0 -9.5485 -11.1226 -17.2638 C 0 0 0 0 0 0 -8.7412 -9.9596 -17.1804 C 0 0 0 0 0 0 -8.1391 -9.6368 -18.0149 H 0 0 0 0 0 0 -9.5669 -11.9191 -18.4439 N 0 0 0 0 0 0 -10.3812 -12.5111 -18.5394 H 0 0 0 0 0 0 -8.6403 -12.0386 -19.4227 C 0 0 0 0 0 0 -7.5787 -11.4151 -19.4628 O 0 0 0 0 0 0 -9.0326 -13.0172 -20.4895 C 0 0 2 0 0 0 -7.9828 -13.8780 -21.1725 C 0 0 1 0 0 0 -8.5985 -12.7210 -21.9125 C 0 0 0 0 0 0 -7.9711 -11.8488 -22.0970 H 0 0 0 0 0 0 -9.3252 -12.9339 -22.6915 H 0 0 0 0 0 0 -8.2299 -14.9031 -21.4408 H 0 0 0 0 0 0 -6.6531 -13.7447 -20.8110 F 0 0 0 0 0 0 -10.0144 -13.4741 -20.3734 H 0 0 0 0 0 0 -11.0124 -11.0557 -14.3155 H 0 0 0 0 0 0 -9.6070 -9.0544 -14.0007 H 0 0 0 0 0 0 -4.7367 -7.5877 -15.8252 Cl 0 0 0 0 0 0 -3.7329 -5.0446 -16.4497 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 36 1 0 0 0 4 5 2 0 0 0 4 35 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 34 1 0 0 0 16 17 2 0 0 0 16 33 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 27 1 0 0 0 25 26 1 0 0 0 25 32 1 0 0 0 26 27 1 0 0 0 26 30 1 0 0 0 26 31 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 M END $$$$ lig_jmc_27 3D Schrodinger Suite 2021-1. 36 38 0 0 1 0 999 V2000 -4.7850 -2.7769 -16.4290 H 0 0 0 0 0 0 -5.3697 -3.6480 -16.1728 C 0 0 0 0 0 0 -4.7769 -4.9212 -16.1644 C 0 0 0 0 0 0 -5.5349 -6.0557 -15.8170 C 0 0 0 0 0 0 -6.9040 -5.9250 -15.4663 C 0 0 0 0 0 0 -7.4991 -4.6383 -15.5006 C 0 0 0 0 0 0 -6.7300 -3.5136 -15.8503 C 0 0 0 0 0 0 -7.1893 -2.5374 -15.8751 H 0 0 0 0 0 0 -9.1768 -4.3997 -15.1586 Cl 0 0 0 0 0 0 -7.7148 -7.1180 -15.0457 C 0 0 0 0 0 0 -8.1389 -7.1991 -13.8934 O 0 0 0 0 0 0 -7.9049 -8.0287 -16.0180 N 0 0 0 0 0 0 -7.4294 -7.8335 -16.8865 H 0 0 0 0 0 0 -8.7326 -9.1839 -16.0340 C 0 0 0 0 0 0 -9.5767 -9.5845 -14.9768 C 0 0 0 0 0 0 -10.3787 -10.7211 -15.1617 C 0 0 0 0 0 0 -10.3684 -11.4682 -16.2855 N 0 0 0 0 0 0 -9.5511 -11.1143 -17.3033 C 0 0 0 0 0 0 -8.7345 -9.9579 -17.2108 C 0 0 0 0 0 0 -8.1156 -9.6410 -18.0354 H 0 0 0 0 0 0 -9.5769 -11.9102 -18.4820 N 0 0 0 0 0 0 -10.4125 -12.4719 -18.5849 H 0 0 0 0 0 0 -8.6418 -12.0583 -19.4429 C 0 0 0 0 0 0 -7.5768 -11.4445 -19.4773 O 0 0 0 0 0 0 -9.0300 -13.0424 -20.5007 C 0 0 2 0 0 0 -7.9790 -13.8599 -21.2474 C 0 0 1 0 0 0 -8.6725 -12.7173 -21.9374 C 0 0 0 0 0 0 -8.0920 -11.8168 -22.1314 H 0 0 0 0 0 0 -9.4254 -12.9488 -22.6885 H 0 0 0 0 0 0 -8.2615 -14.8677 -21.5420 H 0 0 0 0 0 0 -6.2468 -13.7466 -21.0219 Cl 0 0 0 0 0 0 -9.9956 -13.5261 -20.3580 H 0 0 0 0 0 0 -11.0483 -11.0477 -14.3796 H 0 0 0 0 0 0 -9.6507 -9.0421 -14.0475 H 0 0 0 0 0 0 -4.7400 -7.5863 -15.8220 Cl 0 0 0 0 0 0 -3.7318 -5.0262 -16.4169 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 36 1 0 0 0 4 5 2 0 0 0 4 35 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 34 1 0 0 0 16 17 2 0 0 0 16 33 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 27 1 0 0 0 25 26 1 0 0 0 25 32 1 0 0 0 26 27 1 0 0 0 26 30 1 0 0 0 26 31 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 M END $$$$ lig_jmc_28 3D Schrodinger Suite 2021-1. 39 41 0 0 1 0 999 V2000 -4.7734 -2.7882 -16.4516 H 0 0 0 0 0 0 -5.3693 -3.6534 -16.1928 C 0 0 0 0 0 0 -4.7771 -4.9295 -16.1748 C 0 0 0 0 0 0 -5.5384 -6.0580 -15.8222 C 0 0 0 0 0 0 -6.9079 -5.9170 -15.4723 C 0 0 0 0 0 0 -7.5021 -4.6266 -15.5098 C 0 0 0 0 0 0 -6.7258 -3.5070 -15.8679 C 0 0 0 0 0 0 -7.1773 -2.5281 -15.8986 H 0 0 0 0 0 0 -9.1766 -4.3876 -15.1626 Cl 0 0 0 0 0 0 -7.7200 -7.1066 -15.0434 C 0 0 0 0 0 0 -8.1390 -7.1894 -13.8908 O 0 0 0 0 0 0 -7.9167 -8.0154 -16.0156 N 0 0 0 0 0 0 -7.4475 -7.8102 -16.8862 H 0 0 0 0 0 0 -8.7431 -9.1695 -16.0273 C 0 0 0 0 0 0 -9.5769 -9.5853 -14.9643 C 0 0 0 0 0 0 -10.3771 -10.7245 -15.1583 C 0 0 0 0 0 0 -10.3740 -11.4620 -16.2885 N 0 0 0 0 0 0 -9.5582 -11.0924 -17.3052 C 0 0 0 0 0 0 -8.7548 -9.9313 -17.2084 C 0 0 0 0 0 0 -8.1464 -9.5935 -18.0346 H 0 0 0 0 0 0 -9.5735 -11.8790 -18.4906 N 0 0 0 0 0 0 -10.4150 -12.4196 -18.6299 H 0 0 0 0 0 0 -8.6246 -12.0098 -19.4382 C 0 0 0 0 0 0 -7.5447 -11.4192 -19.4291 O 0 0 0 0 0 0 -9.0144 -12.9414 -20.5374 C 0 0 2 0 0 0 -7.9968 -13.8618 -21.2117 C 0 0 1 0 0 0 -8.4999 -12.6404 -21.9316 C 0 0 0 0 0 0 -7.8110 -11.8050 -22.0554 H 0 0 0 0 0 0 -9.1848 -12.7929 -22.7629 H 0 0 0 0 0 0 -8.4286 -14.8054 -21.5270 H 0 0 0 0 0 0 -6.5243 -14.0038 -20.8986 C 0 0 0 0 0 0 -6.0378 -13.0412 -20.7510 H 0 0 0 0 0 0 -6.0098 -14.5270 -21.7113 H 0 0 0 0 0 0 -6.4164 -14.5984 -19.9932 H 0 0 0 0 0 0 -10.0347 -13.3181 -20.4861 H 0 0 0 0 0 0 -11.0392 -11.0690 -14.3787 H 0 0 0 0 0 0 -9.6406 -9.0508 -14.0279 H 0 0 0 0 0 0 -4.7554 -7.5923 -15.8220 Cl 0 0 0 0 0 0 -3.7300 -5.0400 -16.4263 H 0 0 0 0 0 0 1 2 1 0 0 0 2 7 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 3 39 1 0 0 0 4 5 2 0 0 0 4 38 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 2 0 0 0 6 9 1 0 0 0 7 8 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 19 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 37 1 0 0 0 16 17 2 0 0 0 16 36 1 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 21 1 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 25 27 1 0 0 0 25 26 1 0 0 0 25 35 1 0 0 0 26 27 1 0 0 0 26 30 1 0 0 0 26 31 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 31 32 1 0 0 0 31 33 1 0 0 0 31 34 1 0 0 0 M END $$$$