MMs01879214 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 -0.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2889 -2.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 1.4883 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6048 2.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3092 2.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3159 3.7441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9072 2.2324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2029 1.4766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5053 2.2207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8009 1.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1033 2.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2668 3.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7354 4.0054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2284 5.0994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4796 2.7030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4709 1.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9280 0.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3938 -0.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4025 0.9558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9454 2.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6047 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 0.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2564 -1.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0889 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2835 -3.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4889 -2.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0034 -1.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7807 0.1914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9126 3.4324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7381 3.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2807 3.1365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0254 0.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5681 0.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3787 4.5071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 -0.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7594 -1.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5751 0.7011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7523 3.2727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0068 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0298 2.1047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 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 2 0 0 0 0 7 43 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 39 1 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 42 1 0 0 0 0 43 44 1 0 0 0 0 M END