MMs01493773 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5076 -2.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7462 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7386 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0152 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2386 -3.9037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9848 -5.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4848 -5.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2386 -3.9124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 -6.5105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -6.5149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1310 -7.5541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6162 -5.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0415 -5.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0371 -7.2716 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5705 -8.6735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5254 -7.4587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6091 -7.7310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2614 -3.8905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7614 -3.8862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5151 -5.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0151 -5.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7689 -6.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0227 -7.7767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5227 -7.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7689 -6.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7765 -9.0735 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 1.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4538 -1.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9462 -1.3047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -5.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1897 -6.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -7.5480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5788 -4.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1075 -4.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2944 -4.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2345 -5.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5682 -8.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0940 -8.8286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5495 -2.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8878 -3.4724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6121 -4.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9689 -6.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9258 -8.8220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5689 -6.4877 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 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 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END