BEC56V -OEChem-04022100542D 49 52 0 0 0 0 0 0 0999 V2000 2.3660 2.4151 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0490 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.6830 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 0.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8600 -0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 -0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 1.8538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8600 1.0490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8600 1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 1.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 1.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8600 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3600 -1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3600 -1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8600 -2.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3600 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8600 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 -0.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 2.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 -0.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 2.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1700 1.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9426 0.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2523 0.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0500 0.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6700 -2.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3230 -2.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -2.9520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3969 -2.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6700 0.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4800 -0.6830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 32 1 0 0 0 0 3 32 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 5 23 1 0 0 0 0 5 25 1 0 0 0 0 6 21 1 0 0 0 0 6 32 1 0 0 0 0 7 26 2 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 20 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 19 2 0 0 0 0 16 34 1 0 0 0 0 17 21 2 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 27 30 1 0 0 0 0 27 43 1 0 0 0 0 28 31 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$