MMs03832214 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 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 1.2955 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8935 -0.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0245 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1961 -1.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2032 1.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 2.2316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4916 -0.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0896 -0.7928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0826 -2.2928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0489 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6877 -0.8050 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6877 0.3950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6806 -2.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9761 -3.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9691 -4.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2646 -5.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5671 -4.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5742 -3.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2787 -2.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2857 -0.8172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5198 -1.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -1.6790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 0.9106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9859 0.4456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1179 -1.6839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6606 -1.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3839 1.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6189 2.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 3.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8713 2.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6052 1.7134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 -1.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2586 -1.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 1.1633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3978 1.1511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -2.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2649 -3.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9270 -5.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2589 -6.5172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6035 -5.1782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6162 -2.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2815 -1.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9973 1.4388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0393 2.0339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 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 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 50 51 1 0 0 0 0 M END