MMs01677070 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.3448 0.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9374 0.4966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0344 1.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7865 2.8258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4417 2.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3792 2.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 1.8255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0339 2.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9635 1.1686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1311 -0.0793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6871 0.3267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6513 -1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4623 1.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1596 2.5566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2637 -0.0394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7625 0.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5639 -1.2473 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1639 -0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0627 -1.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9922 -2.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3991 -1.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3391 -0.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8951 0.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5310 -3.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4573 -4.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1293 -4.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3822 -2.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4399 3.7898 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5316 1.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0758 -0.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5316 -1.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5151 -1.3654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9357 -0.1693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 4.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4434 2.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6688 3.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2083 3.5254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5258 -1.9024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0676 -2.6117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7769 -1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7058 -1.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5069 1.1932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8728 0.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6674 -3.5197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3974 -2.5101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2809 0.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2746 -4.8619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5453 -3.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3805 -5.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7914 -5.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6855 -5.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9741 -3.9454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1847 -2.7141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3341 -1.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8665 -2.5753 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.0256 -2.8859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 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 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 57 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 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END