9Y1 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 31 33 0 0 0 0 0 0 0 0999 V2000 -5.6708 -1.1184 0.0004 C 0 0 0 0 0 -4.5442 -1.9246 0.0002 C 0 0 0 0 0 -3.2870 -1.3560 0.0011 C 0 0 0 0 0 -0.6559 -0.0032 0.0009 N 0 0 0 0 0 1.7436 0.6575 0.0007 C 0 0 0 0 0 3.5958 -0.5800 -0.0027 C 0 0 0 0 0 4.3383 -1.8493 -0.0000 C 0 0 0 0 0 4.2112 0.6225 -0.0047 C 0 0 0 0 0 -0.3462 4.5433 0.1185 F 0 0 0 0 0 0.5653 3.4884 0.0022 C 0 0 0 0 0 1.2801 3.6197 -1.1928 F 0 0 0 0 0 1.4542 3.5199 1.0821 F 0 0 0 0 0 -0.1799 2.1786 0.0022 C 0 0 0 0 0 -1.5216 2.0270 0.0023 C 0 0 0 0 0 -1.8012 0.6456 0.0022 C 0 0 0 0 0 -3.1515 0.0303 0.0013 C 0 0 0 0 0 -4.2872 0.8376 0.0005 C 0 0 0 0 0 -5.5407 0.2613 -0.0054 C 0 0 0 0 0 -6.9007 -1.6785 -0.0005 F 0 0 0 0 0 0.3800 0.9397 0.0019 N 0 0 0 0 0 2.2607 -0.5301 -0.0006 N 0 0 0 0 0 3.6719 -3.0213 0.0029 O 0 0 0 0 0 5.5547 -1.8418 -0.0002 O 0 0 0 0 0 3.0300 1.8584 -0.0073 S 0 0 0 0 0 -4.6512 -2.9989 -0.0010 H 0 0 0 0 0 -2.4096 -1.9862 0.0019 H 0 0 0 0 0 5.2795 0.7780 -0.0068 H 0 0 0 0 0 -2.2507 2.8236 0.0035 H 0 0 0 0 0 -4.1864 1.9134 -0.0033 H 0 0 0 0 0 -6.4217 0.8862 -0.0052 H 0 0 0 0 0 4.2030 -3.8280 0.0047 H 0 0 0 0 0 23 7 2 0 0 0 22 7 1 0 0 0 7 6 1 0 0 0 6 8 2 0 0 0 6 21 1 0 0 0 8 24 1 0 0 0 21 5 2 0 0 0 24 5 1 0 0 0 5 20 1 0 0 0 4 20 1 0 0 0 4 15 2 0 0 0 20 13 1 0 0 0 17 18 2 0 0 0 17 16 1 0 0 0 18 1 1 0 0 0 9 10 1 0 0 0 15 16 1 0 0 0 15 14 1 0 0 0 16 3 2 0 0 0 1 19 1 0 0 0 1 2 2 0 0 0 13 14 2 0 0 0 13 10 1 0 0 0 3 2 1 0 0 0 10 12 1 0 0 0 10 11 1 0 0 0 2 25 1 0 0 0 3 26 1 0 0 0 8 27 1 0 0 0 14 28 1 0 0 0 17 29 1 0 0 0 18 30 1 0 0 0 22 31 1 0 0 0 M END $$$$