MMs01283673 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 1.4162 -0.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6963 -1.9679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5524 0.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 1.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4085 2.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8247 2.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1048 0.9702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 0.4759 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0153 1.8922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 -0.9403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 -0.0183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0734 0.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4896 0.4668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6258 1.4461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3457 2.9197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0420 0.9519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1782 1.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5944 1.4369 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.2838 2.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7306 2.4163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1468 1.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2829 2.9014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0029 4.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5866 4.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4505 3.8899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0343 4.3842 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.8745 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8469 -1.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5686 -2.4444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0570 -3.5298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0423 -2.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2313 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6145 -0.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8086 -1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6196 -2.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2364 -3.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3954 1.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 0.3954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3954 -1.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1393 2.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1844 4.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7336 3.2273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1927 -1.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1613 -1.1972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 1.7201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6595 2.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9035 -0.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4190 -0.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2661 -0.2270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2487 2.6903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7643 2.9783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3708 0.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4159 2.5060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9118 5.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3626 6.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6565 -0.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7657 1.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9152 -0.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5750 -3.2179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0852 -4.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 36 37 2 0 0 0 0 36 60 1 0 0 0 0 37 38 1 0 0 0 0 37 61 1 0 0 0 0 38 62 1 0 0 0 0 M END