B9U5OH -OEChem-04022100162D 45 48 0 0 0 0 0 0 0999 V2000 4.5981 1.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -2.0347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.4792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -2.0242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 0.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -2.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 -0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 -1.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7340 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5981 -0.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2169 0.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9918 -2.6441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7239 -2.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3303 -0.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1299 -1.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7364 0.5892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1362 -0.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 3.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 18 1 0 0 0 0 3 12 2 0 0 0 0 4 20 1 0 0 0 0 4 29 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 6 10 2 0 0 0 0 6 19 1 0 0 0 0 7 16 1 0 0 0 0 7 19 2 0 0 0 0 8 19 1 0 0 0 0 8 23 1 0 0 0 0 8 37 1 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 13 1 0 0 0 0 11 16 2 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 36 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 38 1 0 0 0 0 25 27 2 0 0 0 0 25 39 1 0 0 0 0 26 28 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 M END $$$$