MMs00657447 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 -1.0325 -1.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4911 -0.7379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5236 -1.8259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0976 -3.2641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9822 -1.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4082 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8667 0.3127 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8993 -0.7754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4733 -2.2136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0147 -2.5638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5887 -4.0020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3578 -0.4252 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.3904 -1.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8489 -1.1630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2749 0.2752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8815 -2.2511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.3400 -1.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7660 -0.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2246 -0.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2571 -1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8311 -2.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3726 -2.9889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8637 -3.7268 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -18.7157 -0.8503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.1417 0.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8704 -0.8260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 0.8704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8704 0.8260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0319 -1.7504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 -2.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5822 0.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4148 -4.8724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4219 -4.2822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3897 -2.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8689 -2.6137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5407 -3.4017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9400 0.4078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5654 1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0318 -4.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9911 0.9287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4825 1.7385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.2923 0.2471 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 4 5 2 0 0 0 0 4 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 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END