B8K4WN -OEChem-04022102212D 45 49 0 1 0 0 0 0 0999 V2000 2.6079 0.6952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9752 -2.0647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6079 2.3716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7866 -1.0189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2435 -0.5081 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.2596 0.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1256 1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1415 -1.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0436 -0.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0356 0.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3935 1.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3935 2.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1256 2.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -1.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2596 2.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4996 0.4988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3717 -0.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9624 1.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4996 2.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5935 1.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5935 2.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9187 -0.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9103 0.5627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8393 -2.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6507 -0.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7406 -1.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 -1.5118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6625 2.3434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2596 3.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5068 -0.1212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -0.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8313 -1.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6755 -1.5385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9505 1.7105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5068 3.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4436 0.8789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 1.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 1.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5272 -3.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3750 -2.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1513 -2.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9628 -1.0513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1864 -0.2035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3386 0.0202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 24 1 0 0 0 0 2 14 1 0 0 0 0 2 25 1 0 0 0 0 3 21 1 0 0 0 0 3 24 1 0 0 0 0 4 22 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 15 1 0 0 0 0 12 19 2 0 0 0 0 13 15 2 0 0 0 0 13 29 1 0 0 0 0 14 22 2 0 0 0 0 15 30 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 23 2 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$