BWR6T7 -OEChem-04022102253D 31 33 0 0 0 0 0 0 0999 V2000 -4.7465 -1.0671 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7223 2.8611 -0.6018 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3878 0.9543 -0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5167 3.0504 -0.8832 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9172 0.3985 -0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4872 0.1006 0.1101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3409 -0.8174 -0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -1.1915 -0.4259 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -1.5886 -1.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7862 -1.7547 -1.4658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 1.0904 0.8331 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4405 0.5720 1.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6388 -1.2893 -0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7641 -1.9634 -0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6129 2.3227 -0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4987 -0.5879 0.5253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0778 0.6014 1.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5294 -0.2117 1.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6923 -1.4799 0.8788 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0802 -2.0894 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -2.3843 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4907 2.0071 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 1.5513 1.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9884 -2.2172 -0.7689 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9202 -2.9558 -0.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7295 1.1577 1.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2464 0.1704 2.1387 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -2.0919 1.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4364 4.0363 -1.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4257 2.6355 -1.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -0.4548 1.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 31 1 0 0 0 0 2 15 2 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 15 1 0 0 0 0 4 15 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 7 2 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 21 1 0 0 0 0 11 17 2 0 0 0 0 11 22 1 0 0 0 0 12 18 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 19 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M END $$$$