MMs01384938 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8839 -2.2727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5805 -3.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2859 -2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5717 -4.5151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3531 -5.3897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -6.8189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3082 -6.8277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7801 -5.4039 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0708 -4.9178 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1913 -5.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6152 -5.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9185 -3.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7358 -6.4403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1596 -5.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4629 -4.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8867 -4.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0073 -5.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7040 -6.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2802 -6.9656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4312 -4.5529 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1785 -3.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4819 -2.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 1.1848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9354 -0.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2431 -2.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2501 -6.6593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7609 -6.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4931 -7.6155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5664 -3.7017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1294 -2.8524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6005 -7.2915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0758 -3.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5246 -1.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -1.2452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 M END