MMs03798284 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 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 1.2956 -0.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2887 -2.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0119 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.2119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6049 1.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3094 2.2440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -0.7679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 1.4761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4848 -2.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7804 -3.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0828 -2.2917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3784 -3.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3715 -4.5477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6809 -2.3036 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6809 -3.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9765 -3.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2789 -2.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5745 -3.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8770 -2.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8839 -0.8275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2858 -0.8156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6048 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 0.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6048 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2564 -1.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0887 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2832 -3.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4887 -2.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8881 -1.9679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 0.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -2.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0692 -3.4055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0048 -3.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5475 -3.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2705 -1.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5053 0.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 0.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5697 0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2009 -3.9753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7436 -3.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5690 -4.2715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9135 -2.9323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9258 -0.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5938 1.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2494 -0.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7298 -0.2084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9074 2.2321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6878 -0.8037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6513 -0.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9129 3.4321 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 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 16 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 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 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 21 1 0 0 0 0 19 54 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 54 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END