MMs02594187 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 0.7549 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2549 -1.2906 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6549 -0.2514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0097 -2.5868 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8097 -2.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2646 -3.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0195 -5.1849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5097 -2.5812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3868 -1.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 0.0605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8152 -1.8225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0254 -0.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 -1.5412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6942 -0.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8127 -1.7859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2077 -3.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7153 -3.0073 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8208 -3.3225 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -3.7914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9378 -5.2197 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3712 -1.7109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9677 -2.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0415 -0.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5961 1.0527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8954 0.2567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8151 0.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9855 -1.5320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8116 -4.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7646 -3.8943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1685 -4.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 35 36 1 0 0 0 0 M END