MMs00856399 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 56 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 1.2946 -0.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2857 -2.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5802 -3.0154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6195 -3.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8837 -2.2731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 -0.7731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3219 -0.3180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1964 -1.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3075 -2.7450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6963 -1.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -2.7644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0001 -2.3093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0090 -0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5852 -0.3374 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5713 -4.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2679 -5.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -6.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5536 -7.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -6.7730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8659 -5.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9658 -7.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3475 -9.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8567 -8.9843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0178 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0267 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 -2.2423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6158 -2.9845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9104 -2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2139 -2.9691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2227 -4.4691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9282 -5.2268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6247 -4.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6062 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6062 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1932 -3.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9667 -3.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 -0.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6051 1.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7501 -4.9545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2162 -7.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9087 -4.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4866 -9.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0911 -10.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3052 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9033 -1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2495 -2.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2655 -5.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5891 -5.0907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 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 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 34 51 1 0 0 0 0 M END