MMs00236692 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.5000 -0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5181 2.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0182 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7409 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4354 4.0278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 4.4066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7843 4.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9916 4.0108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7947 6.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 7.1418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1095 8.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8157 9.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4885 8.6600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 7.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8033 6.4191 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 7.1782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4013 6.4372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4118 4.9373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6951 7.1963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9993 6.4554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0098 4.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3140 4.2145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6078 4.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5973 6.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2931 7.2145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8911 7.2326 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.9120 4.2327 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6072 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0927 -1.0539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 1.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9409 1.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 6.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1529 9.2345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8241 10.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3193 8.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8619 8.1028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6867 8.3963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9748 4.3482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3224 3.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2847 8.4144 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 42 1 0 0 0 0 M END