CPD Converted by convert_cif2sdf.py 2024/03/29 11:09:15 84 85 0 0 0 0 0 0 0 0999 V2000 -7.5407 2.7387 -0.0698 C 0 0 0 0 0 -6.5447 1.7147 0.4112 C 0 0 0 0 0 -4.3120 1.0895 1.1595 C 0 0 0 0 0 -3.2887 1.7629 2.0753 C 0 0 0 0 0 -3.5939 0.4734 -0.0431 C 0 0 0 0 0 -4.6020 -0.1897 -0.9442 C 0 0 0 0 0 -4.9302 -1.5188 -0.7525 C 0 0 0 0 0 -5.2016 0.5305 -1.9593 C 0 0 0 0 0 -5.8549 -2.1282 -1.5801 C 0 0 0 0 0 -6.1231 -0.0802 -2.7890 C 0 0 0 0 0 -6.4515 -1.4084 -2.5983 C 0 0 0 0 0 -0.8327 1.6295 0.6117 C 0 0 0 0 0 0.4535 2.1508 0.0228 C 0 0 0 0 0 0.4194 2.9785 -1.0833 C 0 0 0 0 0 1.6645 1.8051 0.5947 C 0 0 0 0 0 1.5963 3.4582 -1.6244 C 0 0 0 0 0 2.8445 2.2763 0.0548 C 0 0 0 0 0 2.8140 3.1088 -1.0557 C 0 0 0 0 0 4.0425 4.8160 -2.1669 C 0 0 0 0 0 5.2912 5.2870 -2.8675 C 0 0 0 0 0 0.0011 -1.4550 1.6929 C 0 0 0 0 0 1.1296 -2.5745 3.5391 C 0 0 0 0 0 2.3307 -3.4993 3.7471 C 0 0 0 0 0 0.8857 -1.6398 -0.5698 C 0 0 0 0 0 0.3055 -2.9206 -1.1731 C 0 0 0 0 0 1.2956 -3.5007 -2.1855 C 0 0 0 0 0 1.7328 -5.2335 -3.7226 C 0 0 0 0 0 0.6643 -5.7144 -1.6767 C 0 0 0 0 0 -5.2796 2.0847 0.6921 N 0 0 0 0 0 -7.4406 -2.0605 -3.4851 N 0 3 0 0 0 4.0079 3.5934 -1.6021 N 0 0 0 0 0 -0.0628 -1.0842 0.3990 N 0 0 0 0 0 0.9961 -2.2591 2.1147 N 0 0 0 0 0 0.7390 -4.7300 -2.7656 N 0 0 0 0 0 -6.8821 0.5573 0.5444 O 0 0 0 0 0 -2.3452 0.7925 2.5309 O 0 0 0 0 0 -7.9663 -1.4261 -4.3824 O 0 5 0 0 0 -7.7300 -3.2322 -3.3181 O 0 0 0 0 0 -2.6493 -0.4967 0.4135 O 0 0 0 0 0 -1.1965 0.0735 -1.5680 O 0 0 0 0 0 -0.8400 -1.0638 2.4791 O 0 0 0 0 0 3.0694 5.5375 -2.1119 O 0 0 0 0 0 -7.7302 4.0253 1.1796 CL 0 0 0 0 0 -9.1318 1.9413 -0.3571 CL 0 0 0 0 0 5.0852 6.5764 -3.3694 F 0 0 0 0 0 6.3565 5.3040 -1.9613 F 0 0 0 0 0 5.5898 4.4186 -3.9233 F 0 0 0 0 0 -1.2016 -0.0108 -0.0914 P 0 0 0 0 0 -7.1837 3.1840 -0.9980 H 0 0 0 0 0 -4.8339 0.3068 1.7111 H 0 0 0 0 0 -2.7677 2.5453 1.5237 H 0 0 0 0 0 -3.8013 2.2016 2.9313 H 0 0 0 0 0 -3.0717 1.2552 -0.5937 H 0 0 0 0 0 -4.4647 -2.0812 0.0419 H 0 0 0 0 0 -4.9456 1.5685 -2.1081 H 0 0 0 0 0 -6.1118 -3.1665 -1.4312 H 0 0 0 0 0 -6.5886 0.4821 -3.5854 H 0 0 0 0 0 -1.6449 2.3170 0.3766 H 0 0 0 0 0 -0.7286 1.5461 1.6933 H 0 0 0 0 0 -0.5270 3.2498 -1.5247 H 0 0 0 0 0 1.6872 1.1593 1.4595 H 0 0 0 0 0 1.5692 4.1051 -2.4889 H 0 0 0 0 0 3.7896 2.0027 0.4995 H 0 0 0 0 0 0.2238 -3.0716 3.8878 H 0 0 0 0 0 1.2782 -1.6534 4.1034 H 0 0 0 0 0 2.4292 -3.7337 4.8069 H 0 0 0 0 0 2.1822 -4.4204 3.1839 H 0 0 0 0 0 3.2365 -3.0023 3.3995 H 0 0 0 0 0 1.0635 -0.9127 -1.3614 H 0 0 0 0 0 1.8256 -1.8686 -0.0687 H 0 0 0 0 0 0.1276 -3.6478 -0.3825 H 0 0 0 0 0 -0.6344 -2.6918 -1.6752 H 0 0 0 0 0 1.4734 -2.7736 -2.9772 H 0 0 0 0 0 2.2355 -3.7295 -1.6835 H 0 0 0 0 0 1.3635 -6.1508 -4.1821 H 0 0 0 0 0 1.9059 -4.4843 -4.4949 H 0 0 0 0 0 2.6678 -5.4391 -3.2002 H 0 0 0 0 0 0.2551 -6.6489 -2.0597 H 0 0 0 0 0 1.6638 -5.8913 -1.2790 H 0 0 0 0 0 0.0203 -5.3322 -0.8852 H 0 0 0 0 0 -5.0099 3.0101 0.5847 H 0 0 0 0 0 4.8099 3.0491 -1.5735 H 0 0 0 0 0 1.6249 -2.6298 1.4761 H 0 0 0 0 0 -1.7202 1.2576 3.1038 H 0 0 0 0 0 1 2 1 0 0 0 1 43 1 0 0 0 1 44 1 0 0 0 1 49 1 0 0 0 2 29 1 0 0 0 2 35 2 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 3 29 1 0 0 0 3 50 1 0 0 0 4 36 1 0 0 0 4 51 1 0 0 0 4 52 1 0 0 0 5 6 1 0 0 0 5 39 1 0 0 0 5 53 1 0 0 0 6 7 2 0 0 0 6 8 1 0 0 0 7 9 1 0 0 0 7 54 1 0 0 0 8 10 2 0 0 0 8 55 1 0 0 0 9 11 2 0 0 0 9 56 1 0 0 0 10 11 1 0 0 0 10 57 1 0 0 0 11 30 1 0 0 0 12 13 1 0 0 0 12 48 1 0 0 0 12 58 1 0 0 0 12 59 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 14 16 1 0 0 0 14 60 1 0 0 0 15 17 2 0 0 0 15 61 1 0 0 0 16 18 2 0 0 0 16 62 1 0 0 0 17 18 1 0 0 0 17 63 1 0 0 0 18 31 1 0 0 0 19 20 1 0 0 0 19 31 1 0 0 0 19 42 2 0 0 0 20 45 1 0 0 0 20 46 1 0 0 0 20 47 1 0 0 0 21 32 1 0 0 0 21 33 1 0 0 0 21 41 2 0 0 0 22 23 1 0 0 0 22 33 1 0 0 0 22 64 1 0 0 0 22 65 1 0 0 0 23 66 1 0 0 0 23 67 1 0 0 0 23 68 1 0 0 0 24 25 1 0 0 0 24 32 1 0 0 0 24 69 1 0 0 0 24 70 1 0 0 0 25 26 1 0 0 0 25 71 1 0 0 0 25 72 1 0 0 0 26 34 1 0 0 0 26 73 1 0 0 0 26 74 1 0 0 0 27 34 1 0 0 0 27 75 1 0 0 0 27 76 1 0 0 0 27 77 1 0 0 0 28 34 1 0 0 0 28 78 1 0 0 0 28 79 1 0 0 0 28 80 1 0 0 0 29 81 1 0 0 0 30 37 1 0 0 0 30 38 2 0 0 0 31 82 1 0 0 0 32 48 1 0 0 0 33 83 1 0 0 0 36 84 1 0 0 0 39 48 1 0 0 0 40 48 2 0 0 0 M END $$$$