MMs01169878 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 48 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 1.3025 -0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3093 -2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6118 -2.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9074 -2.2322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -0.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3461 1.5162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8119 1.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5678 0.5392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5692 -0.5801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4157 3.2079 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2157 3.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6598 4.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6584 5.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0314 5.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8815 3.5265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0008 2.5279 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0022 1.4086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9994 3.6471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1201 1.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8149 0.0606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9342 -0.9380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3586 -0.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6638 1.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5445 1.9993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4779 -1.4665 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2728 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6172 -4.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9493 -2.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 1.2119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6922 3.7937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8527 5.3916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6843 6.3237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2536 6.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3971 6.1619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2064 4.7748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6753 -0.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6901 -2.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8034 1.3767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7886 3.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END