MMs03233988 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 32 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 1.3028 -0.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3102 -2.2435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1011 -3.1312 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7474 -3.9797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5718 -4.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0718 -4.5480 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9595 -5.7571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5282 -3.1191 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3767 -3.9676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9524 -2.6485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6812 -0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8009 -1.7072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4964 -3.1760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0721 -3.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2252 -1.2366 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3277 -2.6748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6469 -1.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5948 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6007 -4.8108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7032 -5.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3612 -0.3812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9248 0.4659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3921 -3.9744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8285 -4.8216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4374 -3.6841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5805 -3.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 30 31 1 0 0 0 0 M END