MMs01589456 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 -1.0343 -1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6106 -2.5253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4923 -0.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 0.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3739 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4083 -0.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9846 -1.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5266 -1.8202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8662 0.3238 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.5137 1.7818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2188 -1.1342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3242 0.6764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7479 2.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3585 -0.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8165 -0.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2402 1.3815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8508 -1.1438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.3088 -0.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7325 0.6477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1904 1.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2248 -0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8011 -1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3431 -1.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9194 -3.3166 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8691 -0.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8274 0.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8691 0.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0885 1.5742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7129 2.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8120 -2.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1877 -2.9713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5967 2.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0868 3.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8990 1.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3589 -1.0740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8388 -1.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5119 -2.2950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9050 1.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5294 2.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3911 0.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6285 -2.3942 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 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 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 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 M END