BAM13Q -OEChem-04022101092D 46 49 0 1 0 0 0 0 0999 V2000 13.3874 -1.9971 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.3737 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0077 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0077 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.2714 1.2244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 1.2244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2714 1.2244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2714 -0.5077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 0.3583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 2.0904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9084 -1.8371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4049 1.7244 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4049 0.7244 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2714 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4538 2.0334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4538 0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7714 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7714 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8647 -1.4212 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2659 -0.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6078 -2.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4738 -1.5904 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3660 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8865 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7505 2.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7505 -0.0522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4318 0.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 2.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9169 2.3434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9169 0.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -0.1511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5814 1.7613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1888 0.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8791 -0.2523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4745 -0.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8825 -0.5474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2659 0.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1471 -2.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9722 -2.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5063 -2.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 2.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23 1 1 1 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 19 2 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 7 36 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 18 1 0 0 0 0 9 24 2 0 0 0 0 10 18 2 0 0 0 0 10 25 1 0 0 0 0 11 27 3 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 29 1 1 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 1 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 1 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END $$$$