MMs00657365 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 0.0003 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2994 -2.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 -3.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0008 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2984 -3.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2986 -2.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5978 -1.5005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8967 -2.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1959 -1.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 -0.0009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4948 -2.2511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 -1.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0014 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0929 -2.2516 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 -1.5018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 -0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6915 0.7479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9901 -1.5023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6909 -2.2521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2890 -2.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2896 0.7475 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0002 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3386 -1.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -4.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -5.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3375 -4.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1252 -3.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6679 -3.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4946 -3.4511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0927 -3.4516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3532 0.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6917 1.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8892 -1.2134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3281 -2.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6888 -3.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END