9BR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 58 58 0 0 0 0 0 0 0 0999 V2000 -6.9816 1.1045 0.5746 C 0 0 0 0 0 -5.5038 0.8052 0.5937 C 0 0 0 0 0 -4.9323 -0.0993 1.6542 C 0 0 0 0 0 -4.7178 1.3311 -0.3128 C 0 0 0 0 0 -3.2411 1.0312 -0.2930 C 0 0 0 0 0 -2.8162 0.4732 -1.6537 C 0 0 0 0 0 -1.3395 0.1740 -1.6346 C 0 0 0 0 0 -0.3447 1.2657 -1.9343 C 0 0 0 0 0 -0.9199 -1.0358 -1.3577 C 0 0 0 0 0 0.5558 -1.3084 -1.2176 C 0 0 0 0 0 0.8269 -1.9643 0.1372 C 0 0 0 0 0 2.3025 -2.2362 0.2766 C 0 0 0 0 0 2.8929 -3.5014 -0.2901 C 0 0 0 0 0 3.0729 -1.3731 0.8912 C 0 0 0 0 0 4.5252 -1.6956 1.1308 C 0 0 0 0 0 5.3840 -0.5881 0.5760 C 0 0 0 0 0 5.7302 0.4866 1.3754 C 0 0 0 0 0 5.2993 0.5475 2.6607 O 0 0 0 0 0 6.5324 1.5155 0.8491 C 0 0 0 0 0 6.9064 2.6579 1.6852 C 0 0 0 0 0 6.5245 2.7192 2.8354 O 0 0 0 0 0 6.9711 1.4411 -0.4799 C 0 0 0 0 0 7.8309 2.5399 -1.0512 C 0 0 0 0 0 6.6210 0.3750 -1.2571 C 0 0 0 0 0 7.1697 0.2896 -2.9027 CL 0 0 0 0 0 5.8316 -0.6478 -0.7365 C 0 0 0 0 0 5.4911 -1.7029 -1.5185 O 0 0 0 0 0 -7.1804 1.9897 1.1784 H 0 0 0 0 0 -7.3017 1.2851 -0.4519 H 0 0 0 0 0 -7.5290 0.2549 0.9828 H 0 0 0 0 0 -5.7327 -0.4375 2.3131 H 0 0 0 0 0 -4.4621 -0.9618 1.1822 H 0 0 0 0 0 -4.1902 0.4470 2.2358 H 0 0 0 0 0 -5.1274 1.9796 -1.0730 H 0 0 0 0 0 -2.6869 1.9473 -0.0870 H 0 0 0 0 0 -3.0290 0.2958 0.4827 H 0 0 0 0 0 -3.3704 -0.4429 -1.8597 H 0 0 0 0 0 -3.0282 1.2079 -2.4301 H 0 0 0 0 0 -0.8766 2.1716 -2.2271 H 0 0 0 0 0 0.2527 1.4672 -1.0444 H 0 0 0 0 0 0.3086 0.9495 -2.7468 H 0 0 0 0 0 -1.6315 -1.8378 -1.2295 H 0 0 0 0 0 0.8793 -1.9767 -2.0165 H 0 0 0 0 0 1.1067 -0.3699 -1.2841 H 0 0 0 0 0 0.5043 -1.2953 0.9354 H 0 0 0 0 0 0.2770 -2.9021 0.2044 H 0 0 0 0 0 2.1224 -4.0494 -0.8331 H 0 0 0 0 0 3.7073 -3.2502 -0.9698 H 0 0 0 0 0 3.2745 -4.1201 0.5214 H 0 0 0 0 0 2.6667 -0.4298 1.2278 H 0 0 0 0 0 4.7047 -1.7925 2.2017 H 0 0 0 0 0 4.7759 -2.6331 0.6339 H 0 0 0 0 0 5.9001 0.1349 3.2967 H 0 0 0 0 0 7.5224 3.4469 1.2787 H 0 0 0 0 0 8.8819 2.3030 -0.8821 H 0 0 0 0 0 7.6457 2.6261 -2.1216 H 0 0 0 0 0 7.5879 3.4835 -0.5627 H 0 0 0 0 0 6.1190 -2.4369 -1.4845 H 0 0 0 0 0 13 12 1 0 0 0 27 26 1 0 0 0 10 11 1 0 0 0 10 9 1 0 0 0 12 11 1 0 0 0 12 14 2 0 0 0 25 24 1 0 0 0 9 7 2 0 0 0 26 24 2 0 0 0 26 16 1 0 0 0 15 14 1 0 0 0 15 16 1 0 0 0 24 22 1 0 0 0 7 6 1 0 0 0 7 8 1 0 0 0 16 17 2 0 0 0 6 5 1 0 0 0 22 23 1 0 0 0 22 19 2 0 0 0 17 19 1 0 0 0 17 18 1 0 0 0 19 20 1 0 0 0 5 4 1 0 0 0 4 2 2 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 20 21 2 0 0 0 1 28 1 0 0 0 1 29 1 0 0 0 1 30 1 0 0 0 3 31 1 0 0 0 3 32 1 0 0 0 3 33 1 0 0 0 4 34 1 0 0 0 5 35 1 0 0 0 5 36 1 0 0 0 6 37 1 0 0 0 6 38 1 0 0 0 8 39 1 0 0 0 8 40 1 0 0 0 8 41 1 0 0 0 9 42 1 0 0 0 10 43 1 0 0 0 10 44 1 0 0 0 11 45 1 0 0 0 11 46 1 0 0 0 13 47 1 0 0 0 13 48 1 0 0 0 13 49 1 0 0 0 14 50 1 0 0 0 15 51 1 0 0 0 15 52 1 0 0 0 18 53 1 0 0 0 20 54 1 0 0 0 23 55 1 0 0 0 23 56 1 0 0 0 23 57 1 0 0 0 27 58 1 0 0 0 M END $$$$