CHEMBRIDGE-ZINC04532161 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 0.0420 1.1540 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.0790 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.5380 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 0.2350 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.4740 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 1.9320 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 2.2600 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 3.6020 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 4.1260 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 4.3640 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 5.7590 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 6.3920 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 7.7690 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 8.5170 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 7.8900 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 6.5130 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 5.8430 -1.8120 N 0 3 0 0 0 0 0 0 0 0 0 0 7.0610 6.5080 -2.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 4.6270 -1.8720 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6240 -0.2560 1.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6190 -1.3000 1.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 0.3840 1.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8680 1.5080 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.6860 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -1.5010 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.8950 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 1.8380 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 3.9460 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 5.8080 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 8.2620 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 9.5940 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 8.4770 -1.6200 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 20 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 1 0 0 0 0 7 27 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 20 1 M CHG 1 22 -1 M END