CHEMBRIDGE-ZINC03879013 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 2.0270 1.5080 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 0.1520 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.7050 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -0.1930 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 1.1640 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 2.0140 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 1.7100 -2.4620 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4180 0.9620 -3.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 2.9070 -2.6860 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2380 -2.0770 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -2.7920 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -2.1470 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -2.8440 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.1950 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -4.9550 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.2470 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -5.2240 0.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -6.2800 0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -6.2130 0.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -4.8700 0.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7560 -4.2130 0.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -6.0840 0.5270 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6900 2.1760 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -0.2420 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.8560 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 3.0750 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -2.5310 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -1.0700 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -2.2830 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 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 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 20 1 M CHG 1 22 -1 M END