MMs01543592 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7418 1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0164 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7254 3.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2253 3.9112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9835 2.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2417 1.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3985 -1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5195 -2.3518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8138 -1.5936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4927 -0.1284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4893 0.9926 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9585 0.6900 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1176 0.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 -0.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9551 1.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4826 3.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4243 1.5085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4209 2.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8901 2.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8867 3.4479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4142 4.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9450 5.1742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9484 4.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4108 5.9926 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5934 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2164 2.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1188 4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8188 4.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1835 2.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2263 -1.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2921 -1.1116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 -1.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5699 -0.3556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8023 0.3696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2681 1.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0620 3.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5670 6.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7731 4.2952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END