MMs01136682 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 -0.7442 -1.3024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0116 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5116 -2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2674 -3.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5232 -5.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0232 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7326 -3.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2326 -3.9071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9768 -5.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -6.5052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4768 -5.2162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2326 -3.9205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7325 -3.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4767 -5.2296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 -6.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -6.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9767 -5.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8530 -6.4537 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2816 -5.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2883 -4.4966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8638 -4.0267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4912 -6.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3278 -8.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5373 -9.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9104 -8.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0738 -7.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8642 -6.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4468 -6.5627 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0419 -0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5954 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1069 -1.5495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4673 -3.8817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1278 -6.2260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5722 -6.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8372 -2.8706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1068 -3.5050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4462 -2.7397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5294 -2.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 -3.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0767 -4.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8467 -6.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5073 -7.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0915 -6.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4241 -7.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2293 -8.8579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4066 -10.4546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8780 -9.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9950 -5.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 M END