MMs03456765 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 0.7420 -1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5159 -2.5888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2579 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -1.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -3.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5264 -3.6973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2842 -4.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8356 -0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -1.0323 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9544 0.1268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3735 -0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0526 1.4435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5859 -2.4976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0153 -2.9523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1238 -1.9418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3361 -4.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7655 -4.8724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0864 -6.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9779 -7.3482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5158 -6.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7239 -5.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9428 -6.7775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4881 -8.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9881 -8.2161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -1.3110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5777 -3.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0936 1.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9359 -3.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8854 0.1554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3924 0.4854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 -3.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1371 -4.4668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1764 -5.6069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6524 -4.0639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7165 -4.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0818 -6.3997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1993 -9.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8029 -0.4765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6897 0.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 35 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 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 42 43 1 0 0 0 0 M END