BA3FX7 -OEChem-04022102173D 42 44 0 0 0 0 0 0 0999 V2000 3.5006 4.5210 0.5981 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5182 -1.7466 0.1939 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6031 0.1883 -0.8992 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0156 0.8377 -0.2238 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8615 -2.1399 -0.1886 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9343 -2.2702 1.4138 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9998 -0.5050 1.6459 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4559 -2.0191 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0032 -1.1653 -0.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1449 -1.2304 0.7859 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3357 -0.2802 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1551 -1.4282 -1.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2727 -1.7557 -0.0678 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0844 -0.3931 0.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4804 0.0648 -2.1209 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7831 -0.5338 -2.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2938 -2.0370 2.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5133 0.0198 0.3078 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -0.0583 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5741 0.6641 1.1131 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4486 0.7675 -0.4076 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5701 2.0560 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4447 2.1594 -0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5054 2.8037 0.4874 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3529 1.2529 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8147 2.2279 -0.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5413 -2.4712 0.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7759 0.7598 -2.8977 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4813 -0.2886 -2.9108 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8969 -2.0519 -2.0625 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5002 -1.3934 2.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1195 -2.7486 1.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3895 -2.6104 2.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8408 0.1041 1.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 0.2869 -1.0465 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8331 2.5445 1.8353 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1783 2.7294 -0.8822 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0099 0.3765 0.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3718 1.7355 1.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8356 2.5664 -0.7906 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7813 1.7628 -1.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1535 3.1000 -1.0238 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 8 1 0 0 0 0 2 18 1 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 7 19 2 0 0 0 0 8 12 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 27 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$