MMs00951780 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 -1.5000 -0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2487 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4974 -2.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7513 -1.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 -1.2968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2513 -1.2938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5026 -2.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0026 -2.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7513 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5026 -2.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0026 -2.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7539 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2539 -3.8859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0052 -5.1842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2565 -6.4840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5052 -5.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2565 -6.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7565 -6.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5052 -5.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7539 -3.8814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2539 -3.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5026 -2.5846 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1015 -1.5448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0026 -2.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2513 -1.2878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5077 -7.7778 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7487 -1.3028 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0964 -3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 -3.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.4123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2072 1.1850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2904 1.1860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6272 0.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6306 -3.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2954 -3.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8754 -3.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2121 -3.7767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3754 -3.0022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7121 -3.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7930 -1.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1298 -2.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6266 -4.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9634 -5.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6575 -7.5208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7052 -5.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3528 -2.8416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 M END