BMD31S -OEChem-04022106473D 45 47 0 1 0 0 0 0 0999 V2000 7.7320 -2.8002 -0.3038 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1226 0.9272 1.1268 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9521 0.8491 -2.0664 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5641 3.6214 0.1147 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2213 1.5674 -0.8964 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5088 -1.0519 -0.7543 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3719 0.7338 0.2770 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0609 0.0028 0.5784 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5416 -0.2139 0.1209 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3331 -1.5047 -0.3647 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8279 0.2032 0.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.6828 0.8943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8977 0.1812 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6448 -0.6287 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 1.7434 0.8099 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -2.3784 -0.5082 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9058 -0.6704 0.3199 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2987 -0.0805 0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9956 -0.8795 0.4973 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4489 1.4926 0.5692 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6972 -1.9613 -0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3311 2.9225 -0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8754 -1.2702 0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 0.8570 -0.5185 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2263 -1.5222 0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4239 0.6049 -0.7573 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0006 -0.5847 -0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3847 -0.8424 -0.5562 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5816 1.3840 1.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2243 -0.7737 1.3368 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6693 -0.4659 -0.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.8637 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0036 1.2069 0.8412 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0187 -1.4846 0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7542 2.7664 0.9366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2502 -3.3823 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9074 -0.3459 0.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2944 -1.9148 0.3582 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1186 2.3478 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1828 3.3674 -1.8625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3205 -2.0153 1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6606 1.7829 -0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9917 0.9821 -2.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6638 -2.4509 0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0135 1.3421 -1.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 5 1 0 0 0 0 3 43 1 0 0 0 0 4 22 2 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 28 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 16 1 0 0 0 0 10 32 1 0 0 0 0 11 17 2 0 0 0 0 11 33 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 18 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 19 1 0 0 0 0 14 34 1 0 0 0 0 15 20 2 0 0 0 0 15 35 1 0 0 0 0 16 21 2 0 0 0 0 16 36 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 38 1 0 0 0 0 20 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 2 0 0 0 0 24 42 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 M END $$$$