B3PWZ5 -OEChem-04012118452D 26 25 0 0 0 0 0 0 0999 V2000 5.6720 3.6200 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 2.1200 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 0.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 0.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 3.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 2.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 2.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 5.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 22 1 0 0 0 0 4 14 2 0 0 0 0 5 15 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 15 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 16 1 0 0 0 0 8 17 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 12 2 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 M END $$$$