MMs01365403 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 -0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2471 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7471 -1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7529 1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0058 2.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7587 3.8819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5058 2.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7529 1.2906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2529 1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7471 -1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2471 -1.3176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9941 -2.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2412 -3.9156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4941 -2.6216 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8941 -1.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2412 -3.9224 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8412 -4.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4883 -5.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7412 -3.9257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2471 -1.3243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7471 -1.3277 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7504 0.1723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7437 -2.8277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2470 -1.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9941 -2.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4941 -2.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2470 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5000 -0.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7470 -1.3411 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6447 -2.3420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3447 -2.3480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9529 1.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6552 2.3346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6185 -1.7221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9528 -2.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4504 -4.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8860 -6.2576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5262 -5.8220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3389 -4.9663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6494 -0.2837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3918 -3.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0918 -3.6757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1023 1.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4023 1.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 12 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 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 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 M END