MMs01985544 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 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 1.2951 -0.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8932 -0.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -0.7836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8019 1.4596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0893 -0.7971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0815 -2.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3766 -3.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6795 -2.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6873 -0.8105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9747 -3.0672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2776 -2.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2853 -0.8240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5727 -3.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8756 -2.3374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1708 -3.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1630 -4.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8601 -5.3374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5649 -4.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4737 -2.3509 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0617 -1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1171 -1.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6598 -1.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4295 0.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9722 0.8883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0392 -2.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3704 -4.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7296 -0.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 1.1462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9685 -4.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8818 -1.1374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1991 -5.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5226 -5.1753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 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 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 M END