MMs01587839 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 63 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 1.3036 -0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3128 -2.2420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6165 -2.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9109 -2.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2145 -2.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2237 -4.4680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9293 -5.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6257 -4.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3313 -5.2419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0276 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2668 -5.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9385 -6.7259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2421 -7.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2513 -8.9679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5089 -2.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 -0.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8125 -2.9521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1069 -2.1941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4105 -2.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4198 -4.4361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7049 -2.1781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0086 -2.9201 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0086 -1.7201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0178 -4.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3214 -5.1621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6158 -4.4041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6066 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3030 -2.1622 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3422 -1.5622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2938 -0.6622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5936 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7071 0.3881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4866 -0.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 -1.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2666 -5.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7933 -3.5759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7493 -3.5854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8731 -4.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3023 -5.8643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6604 -6.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6456 -6.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4252 -7.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0514 -8.9753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2587 -10.1679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4513 -8.9605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3299 -1.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8726 -1.2701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6976 -0.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8348 -4.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6143 -5.5502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5557 -6.0861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0984 -6.0766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0332 -5.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7963 -4.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7896 -3.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0101 -1.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4937 -0.6548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2864 0.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0938 -0.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 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 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 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 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END