BKB31V -OEChem-04022101432D 40 41 0 1 0 0 0 0 0999 V2000 3.7320 0.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -4.9330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -3.2010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4641 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 0.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 0.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 26 1 0 0 0 0 7 17 1 0 0 0 0 7 40 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 15 31 1 0 0 0 0 16 21 2 0 0 0 0 16 32 1 0 0 0 0 18 22 1 0 0 0 0 18 33 1 0 0 0 0 19 23 2 0 0 0 0 19 34 1 0 0 0 0 20 24 2 0 0 0 0 20 35 1 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 22 25 2 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$