MMs03269049 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 68 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 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4886 -1.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5113 1.4886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 2.2484 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8212 2.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2294 3.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 4.4885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5454 5.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8501 6.7286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1434 5.9688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 4.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8274 3.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4027 -0.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6847 1.5279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 2.2681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0007 -0.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 0.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5987 -0.6925 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6380 -1.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8920 0.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1967 -0.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4901 0.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4787 1.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1740 2.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8807 1.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7720 2.3468 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.6101 -2.1924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8886 -1.5068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4795 -2.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0886 -1.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9954 -0.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1999 -0.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 1.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 3.5489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1725 4.8791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5107 6.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8592 7.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 6.5609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1667 3.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8183 2.5287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6962 -1.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5064 0.1080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6384 -1.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -1.6452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0866 2.6587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 1.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1444 3.1932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6017 3.1815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 -1.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2364 -1.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5158 0.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0584 0.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2058 -1.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5338 -0.5051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1649 3.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8369 2.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5754 -2.8003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0867 1.5083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 0.0280 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.1720 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 5 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 64 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 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 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 64 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 17 65 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 18 64 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 19 65 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 28 62 1 0 0 0 0 30 63 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END