B2SB6E -OEChem-04022101182D 52 54 0 1 0 0 0 0 0999 V2000 7.6761 0.9627 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.5505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.5505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.5505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.0505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4925 -5.8605 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.8938 -4.8424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 0.0117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9548 -0.7974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8992 -4.9470 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0010 3.0505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 4.0505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 4.5505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 4.0505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 3.0505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 2.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 0.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 1.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5481 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1359 -2.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1304 -2.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -3.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7182 -3.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 -4.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3115 -4.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 3.7405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 4.8605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.6705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 2.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 3.1331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 2.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 2.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 5.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.8605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 5.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2986 1.8614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5173 1.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9154 0.6821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5714 -0.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0341 -1.3642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1174 -2.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3826 -1.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1126 -3.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3348 -3.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0648 -4.8089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 13 3 1 1 0 0 0 3 39 1 0 0 0 0 14 4 1 6 0 0 0 4 40 1 0 0 0 0 15 5 1 6 0 0 0 5 41 1 0 0 0 0 6 18 1 0 0 0 0 6 42 1 0 0 0 0 7 11 1 0 0 0 0 8 11 2 0 0 0 0 9 20 1 0 0 0 0 9 21 2 0 0 0 0 10 21 1 0 0 0 0 10 23 1 0 0 0 0 10 46 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 6 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 18 1 6 0 0 0 16 34 1 0 0 0 0 17 19 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 20 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 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 29 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 2 7 -1 11 1 M END $$$$