BMR2K9 -OEChem-04022106312D 44 48 0 0 0 0 0 0 0999 V2000 2.9180 0.5775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4203 0.5743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6622 3.6467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5681 2.1259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 2.1190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4361 2.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3002 2.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4399 3.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1681 2.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3079 4.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 3.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5601 1.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6501 0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7841 1.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6501 -0.4225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7841 -0.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -0.4225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8001 -1.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9021 -2.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -0.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 -2.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8937 -3.5767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7688 -3.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8334 -4.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4337 2.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8998 1.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6968 1.6428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2301 4.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8289 3.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3779 2.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7791 2.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7082 4.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9112 4.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7821 3.5059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3862 4.1977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -0.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4747 -0.6132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -2.2789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2829 -2.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3556 -3.8847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3093 -3.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8357 -4.7392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 13 1 0 0 0 0 5 15 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 22 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$