BBO2V5 -OEChem-04022101452D 40 42 0 0 0 0 0 0 0999 V2000 8.1667 2.0320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4625 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.8285 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.0965 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5461 3.2580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9638 3.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9757 0.6308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1448 2.2399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 1.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5516 3.1535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 1.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 0.4298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.4374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.4374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 1.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 1.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -1.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -0.3548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.7725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2615 1.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.7725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7983 3.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 20 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 23 1 0 0 0 0 5 15 2 0 0 0 0 6 26 1 0 0 0 0 6 40 1 0 0 0 0 7 26 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 15 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 10 16 2 0 0 0 0 10 21 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 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 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 37 1 0 0 0 0 22 25 1 0 0 0 0 22 36 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$