MMs00878762 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 1.5000 -0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 1.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5135 2.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7432 1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7297 3.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2297 3.9088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0271 5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5271 5.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2838 6.4834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2703 3.8853 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7703 3.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 5.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7838 6.4756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 5.1648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9023 3.9467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3313 4.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3392 5.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 6.3737 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5573 6.7781 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7161 6.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2161 6.5068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6161 7.5461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0914 7.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5204 7.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5282 5.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1041 5.2979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0946 -1.0502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4567 1.2810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9432 1.3092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5557 2.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8957 3.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5256 2.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2985 3.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4136 6.9036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9183 7.6819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0491 8.3195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5738 8.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7638 8.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7145 7.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 5.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7839 4.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END