MMs00210702 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.0430 -1.0780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4981 -0.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9102 0.7285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3653 1.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9962 -1.4276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5411 -1.7919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8634 0.3789 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 1.8340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2276 -1.0762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3185 0.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3615 -0.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8166 0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3772 1.4206 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8737 1.3174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2379 -0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9666 -0.9338 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.6292 -0.6984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8104 0.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6002 1.7114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2017 -0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4118 -1.8196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8031 -2.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9843 -1.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7741 0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3828 0.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1727 2.0754 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8624 0.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8344 0.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8624 -0.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0758 1.5909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 2.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8306 -2.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2114 -2.9457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8294 1.8389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3127 1.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3673 -1.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8506 -1.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7973 -1.8865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4669 -2.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9712 -3.5684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0973 -1.9041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7190 0.7692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 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 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 M END