MMs01385291 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 69 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 1.4642 -0.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4783 0.7796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9426 0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3927 -0.9768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9567 1.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6586 3.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9646 3.7672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0698 2.7531 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4469 1.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1847 0.0825 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6846 0.0685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4468 1.3604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4224 -1.2376 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0224 -2.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6603 -2.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 0.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1844 0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9222 -1.2797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1601 -2.5717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6602 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4222 -1.2938 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.4081 -2.7937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4362 0.2061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9221 -1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8151 -0.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2373 -0.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2232 -2.0795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7924 -2.5296 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9786 5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6867 6.0292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6475 6.6292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3807 5.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3666 3.7915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7008 7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2605 1.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1714 0.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2605 -1.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0043 -1.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4759 -0.9710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -0.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6267 -1.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0506 -3.5631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6938 -3.1392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9040 1.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5608 0.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9872 1.2099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3159 0.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2838 -2.9927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9406 -3.7515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8574 -3.7413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5287 -2.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4550 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2147 0.1167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1874 -2.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1584 5.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 6.3908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9809 6.4229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 5.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9456 2.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1869 4.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9007 7.5179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 8.7291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5008 7.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9224 -1.2516 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.3224 -0.2124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 65 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 65 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 65 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 35 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 65 66 1 0 0 0 0 M CHG 1 65 1 M END