BO3D7F -OEChem-04022101292D 46 50 0 0 0 0 0 0 0999 V2000 2.7144 0.0637 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3260 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.1399 3.3960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 -1.7117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6098 0.3719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9605 -1.5055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5485 -1.7117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2438 -2.6579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3698 1.3372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6098 3.3719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7438 -0.1281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7438 -1.1281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2497 -2.6622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6098 1.3719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 -2.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4758 1.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5819 -3.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6034 -3.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4758 2.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 -2.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7438 1.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3698 3.4066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7438 2.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 -2.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 -1.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2758 2.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2758 1.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -0.8868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 -2.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3572 -1.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0079 2.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5317 0.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1332 -0.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1467 0.0619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7745 -3.9959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1893 -3.6618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2068 1.5619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3626 4.0265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2068 3.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -3.3772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4176 -0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8116 1.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7505 -1.5033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7000 2.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5460 2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3158 3.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 3 26 1 0 0 0 0 3 31 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 5 34 1 0 0 0 0 6 15 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 13 2 0 0 0 0 9 16 1 0 0 0 0 9 27 2 0 0 0 0 10 19 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 13 17 1 0 0 0 0 14 16 2 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 20 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 22 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 21 37 1 0 0 0 0 22 26 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 29 1 0 0 0 0 24 40 1 0 0 0 0 25 28 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 42 1 0 0 0 0 28 30 1 0 0 0 0 29 30 2 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M END $$$$