B4CBL2 -OEChem-04022106192D 47 47 0 1 0 0 0 0 0999 V2000 2.4440 -2.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -2.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 -3.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 1.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.9510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -0.9510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3100 0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -1.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 -2.6830 0.0000 B 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 -0.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3881 -0.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7866 0.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 2.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 1.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2541 1.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6526 2.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6994 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6526 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2541 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5746 4.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7775 4.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8926 -0.7389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2023 -0.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2274 -2.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9177 -2.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3926 -1.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 -1.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7274 -2.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4177 -3.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -3.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 -3.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 -1.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 45 1 0 0 0 0 2 17 2 0 0 0 0 3 20 1 0 0 0 0 3 46 1 0 0 0 0 4 20 1 0 0 0 0 4 47 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 7 6 1 6 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 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 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 M END $$$$