MMs03158745 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 53 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 1.2933 -0.7599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8913 -0.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4893 -0.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7940 -1.2597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8055 1.4402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0873 -0.8197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4035 1.4203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6853 -0.8396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2833 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2718 -2.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9670 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6738 -2.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5650 -3.1194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8698 -2.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8813 -0.8794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1630 -3.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4678 -2.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7610 -3.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6079 1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0346 0.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6079 -1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5149 -1.6732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0575 -1.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8337 0.9052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3764 0.8934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1129 -1.6932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6555 -1.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4317 0.8853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9744 0.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7109 -1.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2535 -1.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0055 1.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8147 2.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6055 1.4494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0781 -2.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9992 1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3271 -0.2675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9578 -4.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6300 -2.9315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5558 -4.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3846 -4.0526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9273 -4.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7035 -1.4741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2461 -1.4859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1531 -4.1938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7956 -3.7671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3690 -2.1246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 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 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 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 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 M END