BX8D0H -OEChem-04012119452D 40 41 0 0 0 0 0 0 0999 V2000 3.5340 1.0369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1472 3.9523 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4001 1.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 1.9030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 0.1709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2152 6.8039 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2152 8.4133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.6086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 9.6086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 8.1086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5259 5.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 7.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5044 5.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7988 7.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 4.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1722 6.3914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7935 4.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1507 6.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 7.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4614 5.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 5.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5053 5.2337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4188 7.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9796 6.9808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9862 3.9011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5648 6.6467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 9.9186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0681 5.1068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 10.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 10.4186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 9.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1311 0.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 1.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 17 1 0 0 0 0 3 40 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 7 13 1 0 0 0 0 7 15 2 0 0 0 0 8 12 2 0 0 0 0 8 21 1 0 0 0 0 9 16 1 0 0 0 0 9 23 1 0 0 0 0 9 31 1 0 0 0 0 10 16 1 0 0 0 0 10 21 2 0 0 0 0 11 14 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 16 2 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 27 1 0 0 0 0 17 19 2 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 19 22 1 0 0 0 0 19 29 1 0 0 0 0 20 22 2 0 0 0 0 20 30 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$