MMs01066958 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 0.7605 1.2929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4789 2.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2394 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7394 1.3294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6308 0.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0536 0.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0415 2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6112 2.5500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2742 -0.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1295 -1.7667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6396 0.3475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8602 -0.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2255 0.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7611 -0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1455 -0.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5556 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6838 -3.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1851 -3.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1899 -2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1789 -1.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7142 -1.6310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2623 -3.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7396 -3.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1916 -2.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2184 3.9152 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5916 -1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9605 1.2832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6295 3.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1084 -1.0222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0065 2.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7553 1.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0038 -1.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5393 -1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5465 1.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0820 0.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4580 0.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9639 0.8438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3498 0.5520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3439 -0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6078 -1.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3522 -2.9707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7912 -3.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4800 -4.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5144 -4.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1330 -3.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4919 -3.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0829 -1.7898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8683 -2.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6626 -0.4321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5246 -1.4736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1982 -2.5065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5312 -4.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9293 -4.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7912 -5.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9227 -1.4622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2556 -2.9686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4462 -0.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -4.1678 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9134 -5.3121 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 60 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 60 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 61 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 61 62 1 0 0 0 0 M END