MMs03072729 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -0.7447 -1.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2446 -1.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2553 1.2898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0106 2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5106 2.5796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2553 1.2775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2446 -1.3206 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8446 -0.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4893 -2.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9893 -2.6104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -3.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9786 -5.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4786 -5.2146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -3.9186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7339 -3.9248 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2233 -6.5044 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7446 -1.3391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9893 -2.6350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4893 -2.6289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2446 -1.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9892 -2.6473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0417 -0.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5957 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0417 0.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3846 -1.7079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9482 -2.4847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0553 1.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4149 3.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1149 3.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4553 1.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6914 -2.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -3.9014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0743 -6.2563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7132 1.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 0.3842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7964 1.1457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1292 0.3688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3446 -0.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1152 -3.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7760 -3.8159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6928 -3.8115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -3.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7446 -1.3267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1999 -0.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 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 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M END