MMs02504499 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 0.7422 -1.3035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 -2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 -3.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5312 -5.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0313 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7265 -3.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2265 -3.9106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9843 -2.6161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7109 -6.4996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2109 -6.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0869 -6.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8514 -7.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -8.9273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8529 -9.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3351 -9.7111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1867 -10.9459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0782 -8.4085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5225 -7.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7580 -6.1647 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7973 -5.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8605 -4.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7556 -3.6529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0609 -6.9080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0671 -8.1079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3561 -6.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3484 -4.6513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 -6.8946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6667 -8.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9695 -9.1379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2647 -8.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2570 -6.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9541 -6.1379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5676 -9.1245 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -11.3773 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0427 -11.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5937 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0428 -0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1093 -1.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0199 -3.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5906 -1.5805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9487 -2.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2037 -7.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4109 -6.5158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2181 -5.3086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1909 -6.8362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3667 -9.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2753 -8.4918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0093 -5.0141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4546 -3.6247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3117 -2.5380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7436 -2.9718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6305 -8.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9757 -10.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2931 -6.2759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9479 -4.9379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2302 -12.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2113 -11.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3156 -10.5499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 25 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 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 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 34 2 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 36 37 1 0 0 0 0 37 59 1 0 0 0 0 37 60 1 0 0 0 0 37 61 1 0 0 0 0 M END