9XZ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 30 0 0 0 0 0 0 0 0999 V2000 -3.9099 -0.0433 -0.0002 C 0 0 0 0 0 -0.1833 -0.7048 0.0016 C 0 0 0 0 0 -1.3457 1.4013 0.0005 C 0 0 0 0 0 -4.9773 -0.8387 -0.0015 C 0 0 0 0 0 -2.7759 -2.0486 -0.0001 C 0 0 0 0 0 -2.6847 -0.7066 0.0010 C 0 0 0 0 0 -1.3841 0.0099 0.0014 C 0 0 0 0 0 1.0110 0.0109 0.0019 C 0 0 0 0 0 0.9630 1.4125 0.0020 C 0 0 0 0 0 2.3146 -0.6983 0.0032 C 0 0 0 0 0 5.8369 -0.9096 -0.0031 C 0 0 0 0 0 -0.1973 2.0486 0.0008 N 0 0 0 0 0 2.5034 -2.0256 0.0041 N 0 0 0 0 0 3.5110 -0.1461 -0.0015 N 0 0 0 0 0 3.7776 -2.2304 0.0054 N 0 0 0 0 0 4.3838 -1.0949 0.0016 N 0 0 0 0 0 2.1452 2.1401 0.0024 N 0 0 0 0 0 -4.4696 -2.5212 -0.0015 S 0 0 0 0 0 -3.9881 1.0341 -0.0041 H 0 0 0 0 0 -6.0028 -0.4995 -0.0017 H 0 0 0 0 0 -0.1821 -1.7852 0.0065 H 0 0 0 0 0 -2.2708 1.9587 0.0003 H 0 0 0 0 0 -1.9388 -2.7296 0.0000 H 0 0 0 0 0 2.9992 1.6786 0.0025 H 0 0 0 0 0 2.1180 3.1097 0.0014 H 0 0 0 0 0 6.1995 -0.8582 1.0240 H 0 0 0 0 0 6.3082 -1.7499 -0.5130 H 0 0 0 0 0 6.0841 0.0160 -0.5229 H 0 0 0 0 0 1 4 2 0 0 0 1 6 1 0 0 0 2 7 1 0 0 0 2 8 2 0 0 0 3 7 2 0 0 0 3 12 1 0 0 0 4 18 1 0 0 0 5 6 2 0 0 0 5 18 1 0 0 0 6 7 1 0 0 0 8 9 1 0 0 0 8 10 1 0 0 0 9 12 2 0 0 0 9 17 1 0 0 0 10 13 1 0 0 0 10 14 2 0 0 0 11 16 1 0 0 0 13 15 2 0 0 0 14 16 1 0 0 0 15 16 1 0 0 0 1 19 1 0 0 0 4 20 1 0 0 0 2 21 1 0 0 0 3 22 1 0 0 0 5 23 1 0 0 0 17 24 1 0 0 0 17 25 1 0 0 0 11 26 1 0 0 0 11 27 1 0 0 0 11 28 1 0 0 0 M END $$$$