B9A0OV -OEChem-04022108342D 43 46 0 0 0 0 0 0 0999 V2000 10.4580 -0.6370 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.9418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.6677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0023 -0.4418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9580 0.2290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9580 -1.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 0.3630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5859 0.3630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -1.1370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -1.1370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0023 1.1677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -0.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 -0.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -1.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -0.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0561 0.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0561 -0.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -0.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 0.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 0.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 1.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 -0.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5859 0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7294 -1.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5264 -1.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3925 -0.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5954 -0.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 0.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7871 1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 1.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 1.9830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1949 1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 0.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 -0.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 1 15 1 0 0 0 0 2 17 1 0 0 0 0 2 27 1 0 0 0 0 3 18 1 0 0 0 0 3 27 1 0 0 0 0 4 21 1 0 0 0 0 4 28 1 0 0 0 0 7 26 2 0 0 0 0 8 28 2 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 9 36 1 0 0 0 0 10 26 1 0 0 0 0 10 40 1 0 0 0 0 11 20 1 0 0 0 0 11 28 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 16 2 0 0 0 0 13 19 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 22 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 18 24 1 0 0 0 0 19 24 2 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 35 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$