MMs02766518 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.3034 0.7425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3121 2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6154 2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6241 4.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3294 5.2424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0261 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0174 2.9999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2686 5.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5719 4.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9275 5.2273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2221 4.4698 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9797 5.7645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4646 3.1751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5168 3.7123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5081 2.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8028 1.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1062 2.1973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1149 3.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8202 4.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4008 1.4397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7042 2.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7129 3.6822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9989 1.4247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3022 2.1671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5969 1.4096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8829 -0.8479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1862 -0.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4809 -0.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7843 -0.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7930 1.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4983 2.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1949 1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9003 2.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9089 3.6521 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 -0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6512 2.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1659 5.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6146 3.9210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 3.4723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9344 6.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4654 1.6183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7958 0.2548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1575 4.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8271 5.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3939 0.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2222 0.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7649 0.5010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5455 -0.6843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8759 -2.0479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4739 -2.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8200 -0.7265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8356 1.9735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5052 3.3370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 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 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 35 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 M END