BP3BJ6 -OEChem-04012120342D 59 62 0 1 0 0 0 0 0999 V2000 4.5981 -0.6227 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7404 0.7319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1227 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 2.0191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6227 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4347 0.3718 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4128 0.5797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 -1.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6915 1.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1563 2.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3642 3.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2052 2.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3152 3.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4621 3.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 4.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9973 1.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5232 4.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 2.7393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 5.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0462 1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 5.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3031 1.7612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.1227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8558 0.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 0.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2212 1.1694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3277 -0.7470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4144 0.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9337 -1.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7453 -1.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4891 2.2107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7459 2.8798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 3.5606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 3.6548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0314 4.1439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4581 0.9862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1128 5.1452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0503 3.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3682 5.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 0.4856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9089 6.2291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7134 1.5696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.8127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -5.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -5.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 14 2 0 0 0 0 3 9 1 0 0 0 0 4 9 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 14 1 0 0 0 0 6 16 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 44 1 0 0 0 0 8 23 1 0 0 0 0 8 49 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 1 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 18 20 2 0 0 0 0 18 22 1 0 0 0 0 19 24 1 0 0 0 0 19 45 1 0 0 0 0 20 25 1 0 0 0 0 20 46 1 0 0 0 0 21 26 2 0 0 0 0 21 47 1 0 0 0 0 22 27 2 0 0 0 0 22 48 1 0 0 0 0 23 30 1 0 0 0 0 23 31 2 0 0 0 0 24 28 2 0 0 0 0 24 50 1 0 0 0 0 25 29 2 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 29 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 32 2 0 0 0 0 31 33 1 0 0 0 0 31 56 1 0 0 0 0 32 34 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M CHG 2 3 -1 9 1 M END $$$$