MMs01458759 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 -0.0418 -1.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2359 -2.2853 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1716 -1.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7732 0.3331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5757 -1.6406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5078 -3.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6801 -4.0748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0617 -3.5375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8279 -0.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1692 -1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2583 -2.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5995 -3.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8518 -2.8295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7627 -1.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4214 -0.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 -3.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2821 -4.9984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4453 -2.6752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7865 -3.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0579 -3.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3622 -2.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6559 -3.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6453 -4.5627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -5.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0473 -4.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -5.3219 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1995 -0.0334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0334 1.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1995 0.0334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6295 -1.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4835 -2.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6395 -4.6608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0034 0.0570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5433 0.1486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2565 -3.6444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6708 -4.8532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7645 -0.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3502 0.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2493 -4.4198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8596 -3.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3238 -2.2738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3664 -1.7036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6993 -2.4701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3326 -6.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9961 -5.1371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 21 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 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 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 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END