MMs01013599 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -1.2957 -0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2891 -2.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0132 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 -2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3023 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -3.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -4.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3315 -4.4658 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4675 -5.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9025 -4.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3683 -3.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8255 -2.2881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -1.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 -1.4961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2914 -1.9698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7486 -0.5412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3000 -3.0801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7658 -2.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2231 -1.3332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6889 -1.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6975 -2.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2402 -3.5537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7744 -3.8721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1633 -1.8068 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0053 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3376 -0.1603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3257 -2.8603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3389 -0.1397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4285 -5.6526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5367 -5.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4155 -4.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5573 -3.8785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8318 -0.5374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3625 -0.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1621 -1.3343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -0.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9342 -4.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4162 -0.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0547 0.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0471 -4.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4086 -5.0149 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END