MMs00967629 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -1.5000 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2396 1.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4793 2.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0207 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7603 1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 1.2811 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.2189 3.9149 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7396 1.3288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 0.0477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7395 1.3527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7601 -1.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2601 -1.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1321 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8085 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9152 2.4643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3455 2.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6690 0.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5623 -0.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5742 -1.9650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.5506 -2.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1514 -2.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6992 -3.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7117 -4.9768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5917 3.9290 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1082 -1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6289 3.6324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5218 2.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8639 1.7482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9081 -1.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6358 -1.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9779 -2.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6644 1.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2308 2.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8132 0.1857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2345 -4.1936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8728 -5.3378 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 9 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 29 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 38 39 1 0 0 0 0 M END