MMs02047818 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 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 -0.7442 -1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0116 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5116 -2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2558 -1.2890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2674 -3.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5232 -5.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5318 -6.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3817 -7.7921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5992 -8.6684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9667 -8.0521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1169 -6.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8994 -5.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -4.1923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6242 -3.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0232 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7326 -3.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2326 -3.9071 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9768 -5.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4768 -5.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2326 -3.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -6.5186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7209 -6.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5972 -7.7427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0258 -7.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0325 -5.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6080 -5.3157 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0419 -0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5954 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6669 -0.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -2.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2876 -8.2851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -9.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9407 -8.7531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2109 -6.0667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8473 -5.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1799 -6.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6163 -7.5551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9935 -7.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0065 -5.0846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 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 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 M END