MMs00726921 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.3926 -0.5574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6062 -2.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 -2.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1778 -1.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9642 -0.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5716 0.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5704 -2.2295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 -3.7142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7494 -1.3021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 -1.8595 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8314 -0.7004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3556 -3.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3210 -0.9322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2638 0.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6716 1.0843 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5990 -0.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7642 -1.3409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2819 -2.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7599 -3.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2775 -4.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0979 -0.0374 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.7978 1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2967 1.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9965 2.6732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0957 0.0771 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5946 0.1343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5219 -1.0447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.9298 -0.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2565 -1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5260 -0.4279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4687 1.0710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1420 1.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8726 0.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4293 1.3806 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4459 1.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1141 0.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4459 -1.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1697 -3.7872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9074 0.5545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4007 1.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5785 -0.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1678 -3.5151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5265 -4.5320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5434 -3.1734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1008 -2.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2858 -3.9488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5283 -2.0827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5092 -5.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4600 -4.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6553 1.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9609 2.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5358 -0.9843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3023 -2.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5873 -0.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4843 1.7102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0962 2.9700 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 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 M END