MMs01166492 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 55 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 1.3053 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 -0.7173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 -0.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5138 -2.1955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1693 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1637 0.5898 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4028 1.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9382 1.5584 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0014 3.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4918 3.4272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3836 2.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8740 2.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7659 1.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2563 1.3536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0904 4.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5808 4.9719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1986 6.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9925 5.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3068 7.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4047 6.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2354 8.3909 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5417 -1.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0843 -1.6518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 0.9345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3616 0.9475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1397 -1.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6823 -1.6301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1859 1.2435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4287 -1.7049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8346 3.5385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0751 4.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3095 1.6861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7240 1.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5336 3.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9481 2.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6918 0.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1063 0.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3917 0.1613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4486 1.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1208 2.5460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6358 5.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0276 4.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7059 4.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2716 7.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5933 8.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8243 6.8581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9397 5.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5554 7.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 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 23 1 0 0 0 0 21 24 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 M END