MMs01252516 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 55 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7547 -1.2963 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4453 -1.2963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7641 -3.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -3.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 -2.5872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5093 -2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -3.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -3.8727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5187 -5.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7734 -6.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2734 -6.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5187 -5.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0187 -5.1853 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2547 -1.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7546 -1.2747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7546 -1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2546 -1.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0093 -2.5548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 0.0433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4999 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2452 1.3505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4905 2.6468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9905 2.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2452 1.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7452 1.3342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.7452 1.3559 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.2547 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 -0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9127 -1.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9071 -3.3727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3621 -4.3089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9767 -5.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3603 -2.8313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7187 -5.1647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3771 -7.5078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6772 -7.5176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3708 0.4334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7041 1.2096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1584 -2.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1037 -0.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0868 3.6882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3868 3.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.1099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3808 -0.8764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 M END