MMs01169752 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.5000 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2507 -1.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 -1.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7493 1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2493 1.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8810 1.2171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3079 0.7543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3087 -0.7457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8823 -1.2099 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5226 -1.6267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8926 -1.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0487 0.4760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1066 -1.8970 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4172 -0.7378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9506 -3.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5806 -3.9996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1646 -4.2699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4766 -1.2861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6906 -2.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5346 -3.6590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0606 -1.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3600 -2.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4742 -1.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8634 0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3717 -0.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0006 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0006 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6512 -2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3512 -2.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3488 2.3405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6488 2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3978 -2.8202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9506 -4.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0919 -2.9036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4846 -4.4883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0693 -5.0956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4598 -5.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1358 -4.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8694 -3.2987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6014 -0.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0606 -2.7564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6552 -3.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2522 -3.1082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1801 -2.2719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5131 -0.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0045 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6133 1.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1782 0.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3711 1.1110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 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 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END