BBV1F3 -OEChem-04022106222D 52 55 0 1 0 0 0 0 0999 V2000 2.0000 -2.8770 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.2430 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.5110 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 -1.3770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6230 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4103 -0.5723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.6230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -2.1817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6745 3.0236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1230 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 1.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.6230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -1.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 0.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -3.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6995 0.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0102 1.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3673 -0.1598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9887 1.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3458 0.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6565 0.9969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3423 2.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 3.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 3.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 2.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 2.7056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7004 0.9979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1072 0.4656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1317 -3.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9136 -3.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 -2.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1747 -0.7491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1813 2.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7599 -0.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2632 1.1248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 4 20 2 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 16 1 0 0 0 0 6 17 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 11 7 1 6 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 18 1 0 0 0 0 8 20 1 0 0 0 0 8 23 1 0 0 0 0 9 18 1 0 0 0 0 9 22 2 0 0 0 0 10 31 3 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 17 18 2 0 0 0 0 19 22 1 0 0 0 0 19 43 1 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 25 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 26 1 0 0 0 0 24 27 2 0 0 0 0 26 28 2 0 0 0 0 26 31 1 0 0 0 0 27 29 1 0 0 0 0 27 49 1 0 0 0 0 28 30 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END $$$$