MMs01282539 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2973 0.7530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2939 2.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2871 5.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 4.5059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5912 3.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8852 5.2589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8817 6.7589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1859 4.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3461 3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 2.7119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 4.0126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5548 5.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8633 6.5930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0525 4.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6595 5.5445 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9369 2.9613 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4283 3.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3128 1.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8042 2.0702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4112 3.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5267 4.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0353 4.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2837 6.7529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6024 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6024 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0447 2.3976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0508 5.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6318 2.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4561 2.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0038 6.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9697 7.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4513 1.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8272 0.8126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5117 1.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6043 3.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0123 5.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3278 5.4624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2431 7.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END