BW42QB -OEChem-04012116452D 54 55 0 0 0 0 0 0 0999 V2000 5.5519 0.0000 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 7.4399 6.6980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2152 3.3132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0182 9.0115 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8580 6.6174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0397 8.8053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7291 7.8548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9967 9.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8120 9.9900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2244 8.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7506 7.6485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4614 6.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5044 6.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2152 4.9226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1507 5.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7935 7.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5259 5.8731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1722 5.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 7.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 3.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7988 4.1179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.1179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.1179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 4.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 3.6179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1687 7.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0192 9.4249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4259 8.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7496 7.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3429 7.7674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1246 8.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6034 9.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8689 9.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4187 10.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6842 10.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2053 9.8621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6178 7.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3523 7.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8311 8.1608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 8.2682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1367 7.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5648 5.0798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9862 7.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9796 4.7457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 7.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4188 4.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 5.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 2.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 7.3754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3613 8.1573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5794 7.7606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 17 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 11 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 22 2 0 0 0 0 15 19 1 0 0 0 0 15 43 1 0 0 0 0 16 20 2 0 0 0 0 16 44 1 0 0 0 0 18 21 1 0 0 0 0 18 23 2 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 22 47 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 24 26 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M CHG 2 1 -1 4 1 M END $$$$