B5SUX1 -OEChem-04022101182D 52 54 0 1 0 0 0 0 0999 V2000 7.6761 0.6627 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5536 -2.1154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 -0.2883 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9548 -1.0973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.7505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 3.7505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 4.2505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 3.7505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 2.7505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 2.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 0.6627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 -0.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 0.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5481 -2.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1359 -2.8199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -3.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7346 -3.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 -4.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3279 -4.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9102 -5.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9157 -5.5605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.1305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 3.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 4.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 2.1429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 2.8331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 1.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 1.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2986 1.5614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5173 1.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9154 0.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5714 -1.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6499 -3.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5666 -2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3702 -3.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9336 -4.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7113 -4.8163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2746 -5.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6635 -6.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 11 3 1 1 0 0 0 3 38 1 0 0 0 0 12 4 1 6 0 0 0 4 39 1 0 0 0 0 13 5 1 6 0 0 0 5 40 1 0 0 0 0 6 16 1 0 0 0 0 6 41 1 0 0 0 0 7 21 2 0 0 0 0 8 18 1 0 0 0 0 8 19 2 0 0 0 0 9 19 1 0 0 0 0 9 21 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 6 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 16 1 6 0 0 0 14 33 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 18 20 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 25 27 2 0 0 0 0 25 49 1 0 0 0 0 26 28 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END $$$$