MMs03081681 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 47 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 -1.3000 -0.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3018 -2.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0032 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5981 -1.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5962 1.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8943 2.2548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -0.7452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1943 1.5064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4961 -0.7420 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4961 0.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4979 -2.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1998 -2.9936 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2013 -4.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0942 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -2.2388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3905 1.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6886 2.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6867 3.7644 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.6867 4.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9848 4.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9830 6.0160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5987 -1.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.5987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5987 1.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2607 -1.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5018 -2.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3033 -3.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1018 -2.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8995 -1.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6795 -2.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9098 -3.3691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7927 1.2096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8041 -1.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5738 0.2226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2089 1.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9786 2.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1004 1.1372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8701 2.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2963 2.2516 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -14.2848 3.7676 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -10.3868 4.5128 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.7880 3.4728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3468 5.1115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9855 5.5527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 19 37 1 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 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 43 -1 M CHG 1 44 -1 M CHG 1 45 1 M END