MMs03900647 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.7486 -1.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2486 -1.3015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6486 -0.2623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9971 -2.6014 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5971 -3.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 -3.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7457 -3.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9942 -5.1995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4858 -5.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7961 -6.8255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4962 -7.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3826 -6.5691 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0720 -7.7282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -6.8794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0874 -5.7635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4971 -2.6031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2486 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6289 -2.5211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0560 -2.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3542 -2.8106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6541 -2.0620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6557 -0.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3575 0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0576 -0.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6316 -0.0940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1696 1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9523 -2.8135 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 -0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3795 -1.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9556 -2.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0386 -0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6012 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9614 0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4872 -4.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6794 -5.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9377 -6.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2829 -7.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2004 -8.5457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6035 -8.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0959 -3.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2568 -3.6619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3528 -4.0106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6956 0.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3589 1.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3113 1.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8001 2.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 0.9635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4499 -8.3054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7242 -8.5536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 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 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 54 55 1 0 0 0 0 M END