BN4OK2 -OEChem-04012116502D 39 41 0 1 0 0 0 0 0999 V2000 2.2522 3.3502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7079 4.9669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 -4.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7248 2.5875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9278 0.6570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9277 0.6570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2368 -0.2940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7467 2.3796 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2467 3.2456 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9158 3.9888 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8294 3.5820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 1.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6187 -0.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 -0.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 -1.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2938 -2.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5617 -2.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2938 -3.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5617 -3.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 -3.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2938 -5.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1369 1.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0245 3.8245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3977 4.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4358 3.4531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 4.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1856 2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 1.8128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9093 1.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1687 5.3818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0291 -0.4856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8307 -2.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0248 -2.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8307 -3.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0248 -3.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9838 -5.9187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8307 -5.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6038 -4.8449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9 1 1 6 0 0 0 1 30 1 0 0 0 0 10 2 1 6 0 0 0 2 31 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 6 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$