BKWJ42 -OEChem-04012114412D 45 47 0 0 0 0 0 0 0999 V2000 7.7342 -0.9495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 -0.9254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5160 2.1092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 2.0746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 -0.9696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3984 0.5338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5945 -2.4254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0022 -0.9562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1343 -0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8663 -0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3983 0.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3983 -0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5983 -0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2702 -0.9629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5044 -0.9601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5044 1.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 -0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5983 0.5954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 1.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 0.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9964 -0.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -0.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8624 -0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9964 -1.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7285 -0.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8624 -2.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7285 -1.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6055 -1.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4026 -1.4296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 0.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7339 0.0138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 0.0236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4659 0.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8735 -1.4394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6705 -1.4363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5116 -1.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0626 0.9075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6673 0.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8624 0.1946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4595 -2.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2654 -0.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8624 -3.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9826 2.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1314 -2.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 12 1 0 0 0 0 2 17 1 0 0 0 0 3 16 1 0 0 0 0 3 43 1 0 0 0 0 4 19 2 0 0 0 0 5 22 1 0 0 0 0 5 44 1 0 0 0 0 6 22 2 0 0 0 0 7 27 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 14 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 19 1 0 0 0 0 12 15 2 0 0 0 0 13 15 1 0 0 0 0 13 18 2 0 0 0 0 14 22 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 18 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 M END $$$$