BKTP80 -OEChem-04022102172D 48 51 0 1 0 0 0 0 0999 V2000 11.0233 0.2184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0406 2.6596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 2.6315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0052 -1.1828 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3007 1.3995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.7655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.8995 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3007 0.3995 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3497 0.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 0.8995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1097 -0.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3497 1.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1392 -1.6828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7484 -1.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3471 -2.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3416 -2.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4804 1.4519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8532 0.6810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8127 -0.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6018 -0.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 0.6874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 0.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8023 1.7639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8870 -1.1164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5495 -1.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2853 -2.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1128 -1.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7305 -2.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3471 -3.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2127 -3.3720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9313 -2.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 0.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 0.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 2.8795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 3.1371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.9555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.5755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 12 2 0 0 0 0 3 17 2 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 5 32 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 1 0 0 0 7 12 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 6 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 17 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 M END $$$$