B85AIS -OEChem-04022118543D 28 30 0 0 0 0 0 0 0999 V2000 -2.6116 2.5478 -1.1018 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6037 -2.7824 0.1148 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0394 0.2437 1.0168 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8993 -0.2644 -1.1424 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6383 1.1435 -0.3716 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6348 -1.2059 0.1652 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0596 0.6204 2.5796 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3353 0.1370 0.5811 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2212 -0.1807 -0.7696 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2191 -0.0045 -0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5599 0.2866 1.2326 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1667 0.0513 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3879 -0.3635 -1.5309 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7109 0.1010 0.4596 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1497 -0.1792 -0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6287 -0.2183 -0.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5921 -0.1181 -0.4963 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3149 1.0512 -0.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3115 -1.2261 -0.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6922 0.3666 1.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2266 -0.0061 0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7676 0.4676 1.9652 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6212 0.5345 2.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3346 -0.6118 -2.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8758 -0.4252 -1.7963 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6877 0.2075 0.9251 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -0.3565 -1.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2892 0.0390 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 22 1 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 5 18 2 0 0 0 0 5 21 1 0 0 0 0 6 19 1 0 0 0 0 6 21 2 0 0 0 0 7 20 3 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 13 2 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 15 2 0 0 0 0 12 20 1 0 0 0 0 13 16 1 0 0 0 0 13 24 1 0 0 0 0 14 16 2 0 0 0 0 14 26 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 21 28 1 0 0 0 0 M END $$$$