MMs01511453 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.4899 -0.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0848 -1.5504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3204 -2.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3116 -3.9668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6886 -3.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5484 -1.8786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7717 -1.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1351 -1.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2753 -3.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0521 -3.9973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6388 -3.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 -5.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8620 -2.8864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2255 -3.5117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4487 -2.6435 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5806 -1.4203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3169 -3.8668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6720 -1.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0354 -2.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2587 -1.5326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1185 -0.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7551 0.5862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5318 -0.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3418 0.8290 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1731 -2.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1387 1.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 0.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1387 -1.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4196 1.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6575 0.1040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6595 0.1843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1137 -0.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1642 -5.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7499 -1.6916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3376 -4.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1476 -3.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3495 -2.0328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4410 0.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2852 -1.7865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3678 -3.0934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0609 -4.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END