CHEMBRIDGE-ZINC04988972 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.3740 0.8430 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -0.5160 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -1.0500 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -0.2260 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 1.1330 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 1.6670 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -0.8090 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -1.7230 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -1.4090 -3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -0.0930 -3.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 -1.1460 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 0.0470 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 0.1530 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4880 1.2470 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 2.2360 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 2.1300 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 1.0330 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 3.1880 -2.6210 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2810 4.1530 -2.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 3.0950 -3.7630 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3680 1.2610 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -1.1600 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.1120 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 1.7770 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 2.7290 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.2090 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -1.8320 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -1.5960 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.7510 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -1.4660 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -2.1320 -4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 0.1740 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -1.4210 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6540 -1.9830 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -0.6190 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 1.3300 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 3.0910 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 0.9480 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -0.8090 -1.3960 N 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 39 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END