MMs02481873 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 0.4800 -1.4211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4189 -2.9199 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4189 -4.1199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8254 -3.4411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 -4.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4488 -6.0118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8633 -5.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7937 -3.8760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -2.4820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7558 -2.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9243 -1.0161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2002 -4.3973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1391 -5.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6948 -6.3011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4487 -3.5658 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7593 -4.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8552 -4.0871 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0143 -4.3977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7856 -2.9105 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3856 -1.8713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9541 -1.6621 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1056 -0.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5098 -2.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4754 -0.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9541 -0.0037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2844 -2.9716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2602 -5.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8295 -3.7514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0001 -1.1778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1369 0.3840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.1369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5684 -0.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3413 0.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0804 -6.6404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2949 -0.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4824 0.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3711 1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8415 -4.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4228 -5.8285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -3.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2118 -0.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 29 41 1 0 0 0 0 30 42 1 0 0 0 0 M END