MMs00649727 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 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 0.7571 -1.2949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4858 -2.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2287 -3.9093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4716 -5.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0283 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7712 -3.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2712 -3.8848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1463 -2.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5754 -3.1222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5835 -4.6222 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5835 -5.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1595 -5.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7038 -6.5226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8019 -5.4972 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1688 -4.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3175 -3.3870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6845 -2.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8331 -1.2769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2001 -0.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4184 -1.5343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2697 -3.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9028 -3.6445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7541 -5.1371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3871 -5.7547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9724 -6.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3394 -5.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5577 -6.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4091 -7.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0421 -8.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8238 -7.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7854 -0.9168 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0359 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0915 -1.5703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4287 -3.9159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -6.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -6.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8184 -1.9471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7695 -3.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8585 -0.5768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3190 0.5348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2444 -3.7270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -4.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6513 -5.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3837 -8.4623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9232 -9.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7302 -7.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END