BXYH20 -OEChem-04022100262D 38 40 0 1 0 0 0 0 0999 V2000 3.0402 -5.9554 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8493 -1.3676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2248 5.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0659 4.2534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 2.1720 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.6386 2.5084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 3.8933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5522 2.9151 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7213 1.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 1.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2158 2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 0.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5402 -0.4166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0402 -1.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -0.4166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2312 -1.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0402 -2.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0169 4.5624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9063 -3.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1742 -3.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9063 -4.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1742 -4.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0402 -4.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 3.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1017 2.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2806 1.6599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8324 2.3413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 2.8931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7446 0.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3497 4.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1758 0.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6416 -1.5592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4432 -3.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6373 -3.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4432 -4.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6373 -4.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7641 5.9554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 11 2 0 0 0 0 4 19 1 0 0 0 0 4 38 1 0 0 0 0 5 19 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 31 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$