MMs03505198 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 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 0.7596 -1.2935 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3596 -2.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2595 -1.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0191 -2.5759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0221 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4905 0.1899 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6496 0.5005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7915 1.6594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 2.3998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3797 1.3879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9102 1.6889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3192 3.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5024 -0.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9673 -0.5947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4808 -2.6091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8808 -3.6483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2404 -1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7403 -1.3267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7595 1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 2.5648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 2.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7594 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 -0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2212 -3.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4616 -5.2071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0348 0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5174 -0.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9355 1.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2715 2.7592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5117 4.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 5.0828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1268 3.7561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6781 -1.1062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4574 -0.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5232 -2.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8649 -1.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5595 1.2802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9267 3.6085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6266 3.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9594 1.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5922 -1.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0494 -2.3473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0192 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6268 -3.6328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7212 -3.9247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3135 -4.9683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8589 -3.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 46 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 45 50 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M END