MMs01443928 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 -0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2517 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7517 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7483 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2483 -1.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0079 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -1.5079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 1.4921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2483 -1.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7483 -1.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7517 1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2517 1.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7517 1.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7483 -1.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2483 -1.3178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1284 -2.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6630 -3.9585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5555 -2.0708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.5575 -0.5708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1316 -0.1054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6699 1.3218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1096 -3.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0478 -2.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6621 -3.5915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1543 -3.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0323 -2.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4180 -1.1591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9258 -1.0069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3115 0.3616 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 22.5246 -2.6798 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0016 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6531 2.3361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3531 2.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3469 -2.3440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6469 -2.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1201 -1.7188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4551 -2.4919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5383 -2.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8754 -1.7238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8799 1.6951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5449 2.4682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1246 1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4616 2.4697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6201 -1.7248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9551 -2.4979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5293 0.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9944 -3.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3312 -4.0224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2247 -3.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3109 -4.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6458 -4.8386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1204 -0.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 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 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 17 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 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 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 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 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 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 M END