MMs01069779 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2552 -1.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7552 -1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7447 1.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2447 1.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9895 2.6343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3738 4.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4845 5.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7866 4.2656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4806 2.7971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4888 1.6864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1828 0.2180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4849 -0.5268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5955 0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9799 1.8492 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.0640 0.1754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0632 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5317 0.9882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0009 -0.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0017 -1.5552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5333 -1.2493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4694 -0.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4686 0.3763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6594 -2.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3594 -2.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3405 2.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6406 2.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7963 -1.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1292 -0.3817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 0.9264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0411 0.1497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1991 4.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3543 6.2032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8808 4.7581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0430 1.9260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5082 2.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5687 2.1877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7193 1.1600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3115 -1.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0219 -2.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5567 -2.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3456 -1.4211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4962 -2.4487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7447 1.3262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1405 2.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9387 -2.1671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1134 -2.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 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 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 51 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M END