BSH8O2 -OEChem-04012117142D 47 49 0 0 0 0 0 0 0999 V2000 10.3312 -0.9573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8613 0.0185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.5427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0911 0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.4573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0911 2.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 1.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9972 0.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4848 2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6865 2.5471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6081 1.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2063 2.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -0.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -0.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0840 -0.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9091 2.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2891 1.5057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 1.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 1.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 17 2 0 0 0 0 3 19 2 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 5 34 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 40 1 0 0 0 0 7 22 1 0 0 0 0 7 26 2 0 0 0 0 8 26 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 31 1 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$