MMs00639484 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 1.3005 0.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.7423 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9378 1.3423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9016 2.2423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 2.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 4.4948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3035 2.2474 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0059 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 -1.5024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8166 -1.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5692 -0.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 0.5971 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0612 -0.3658 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5951 -1.5051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -2.2577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 -2.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2916 -3.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0089 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5892 -4.5051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5979 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 2.8402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 4.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0321 3.6021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 1.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4566 -2.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3025 -2.9144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2916 -4.9526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6069 -3.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0493 -5.0979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -5.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9871 -5.5432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6272 -5.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1912 -3.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END