B2KY3P -OEChem-04042105463D 25 26 0 0 0 0 0 0 0999 V2000 -2.7402 -2.9848 0.0009 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0036 2.5444 0.0013 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6503 -1.1533 0.0022 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5456 1.6533 -0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2655 0.0669 -0.0017 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7288 0.8856 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8186 1.3032 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6466 0.0916 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6574 -0.5075 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 1.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2271 1.3425 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8281 -1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1417 0.7620 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3934 -1.1348 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0703 -0.6312 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6781 -2.4921 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 2.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7168 -1.0436 -0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0421 2.6050 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2747 1.6095 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1088 1.2561 0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9909 -1.2092 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 -2.5777 -0.8998 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0561 -2.5774 0.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4164 -3.2988 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 14 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 17 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 8 11 2 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 12 15 2 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 14 16 1 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 M END $$$$