MMs01689918 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.5000 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 1.3072 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8453 2.3464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7453 1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4906 2.6144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9905 2.6198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7452 1.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2452 1.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9905 2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2358 3.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7358 3.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9811 5.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 5.2124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7264 6.5196 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9717 7.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9663 9.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 8.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4906 2.6035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7547 1.2963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7641 3.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0188 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7735 6.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2735 6.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0188 5.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2641 3.8889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 2.5872 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2176 -1.8946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8585 -2.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 -0.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8868 3.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 0.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 0.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1905 2.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8321 4.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9264 6.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1308 8.1265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1473 9.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5518 10.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 7.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 9.4777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0868 3.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1812 5.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1773 7.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8773 7.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2188 5.1809 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 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 M END