MMs02838038 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 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 1.3519 0.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4649 2.1457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8168 2.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0556 1.9499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9426 0.4541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5907 -0.1958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5332 0.2583 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1832 -1.0936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8833 1.6102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8851 0.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1239 0.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4758 0.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5889 2.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 3.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9982 2.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9407 2.8581 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1795 2.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2235 0.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6630 0.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1681 -1.3210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5088 1.3302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5920 2.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0135 3.9570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0081 1.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7198 2.6946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2191 2.7385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0068 1.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2952 0.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7958 0.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0829 -1.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3712 -2.4555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5823 -1.0911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3700 -2.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0363 -0.4038 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.0815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0815 -0.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.0815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4739 2.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9073 3.9922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0335 -1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4669 0.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4405 4.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0071 3.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0312 4.0547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0896 3.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7885 3.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2063 1.4971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2265 -0.9587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3487 -2.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0001 -3.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.3912 -1.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1814 -0.3917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0909 -1.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 8 53 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 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 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 53 54 1 0 0 0 0 M END