MMs00747888 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 0.7463 -1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 -1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2463 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4927 -2.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9927 -2.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7463 -1.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6246 -2.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0524 -2.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0567 -0.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6314 -0.1070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2727 0.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6413 -0.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9424 0.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1034 1.9274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0543 -0.5708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4403 -1.9394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1867 -3.2406 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.9490 -1.7784 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5224 -0.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5230 -1.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0554 -2.8059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0409 0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4029 1.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1029 1.0248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0897 -3.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3897 -3.6441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2505 -3.6743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0213 -2.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1506 1.4974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0760 0.8508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5419 0.3699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9910 -1.0729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7915 -1.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 38 39 1 0 0 0 0 M END