MMs02279091 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7424 -1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 -1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2575 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7576 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0151 2.5805 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0262 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8999 1.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2423 -1.3296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7423 -1.3384 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4317 -2.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0437 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.0999 0.9955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7575 1.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2575 1.2684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9653 -0.3642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1133 -1.8568 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.1526 -1.2568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7395 -2.4589 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5880 -3.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4191 -3.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4080 -2.6144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3992 -4.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6939 -4.8719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9973 -4.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2919 -4.8871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.0060 -2.6295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.0487 -2.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7114 -1.8720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7201 -0.3720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4848 -2.6243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9848 -2.6155 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1364 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1636 2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8875 1.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 2.4426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2757 -4.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3565 -4.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6869 -6.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0787 -3.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 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 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 30 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 32 42 1 0 0 0 0 M END