MMs00031519 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 0.7590 -1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2589 -1.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2589 -1.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5179 -2.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0179 -2.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 -1.2523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7408 1.3457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7408 1.3665 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3408 0.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1212 2.7326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2289 3.7440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5331 3.0030 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5331 4.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2314 1.5336 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5420 0.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5356 0.7926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6434 1.8040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0238 3.1701 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2238 3.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7648 4.4743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2648 4.4847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0237 3.1909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0057 5.7889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5057 5.7993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2467 7.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4877 8.3973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2287 9.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7287 9.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4876 8.4180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7467 7.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 0.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6072 1.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0351 -0.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -1.2938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0254 -2.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5748 -3.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0613 -3.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3927 1.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0927 1.0745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1251 -3.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4251 -3.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -2.2873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0861 2.1254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4091 3.6985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3554 0.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6784 2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1576 5.5093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3986 6.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3055 4.6161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6362 5.3966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2877 8.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6215 10.7365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3215 10.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6876 8.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3538 6.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 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 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 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 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 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 29 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 35 2 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 35 60 1 0 0 0 0 36 61 1 0 0 0 0 M END