CHEMBRIDGE-ZINC04122590 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3800 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.1450 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -0.5310 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 1.2720 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.9420 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -0.6500 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.0380 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 1.2540 -0.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -0.6840 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.0830 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -2.7530 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 -2.0410 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 -0.6490 -0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 0.0280 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7140 0.1040 -0.6240 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7020 1.3220 -0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -0.4940 -0.7280 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6660 -2.7220 -0.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9040 -3.5850 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0990 -5.0240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 -4.8030 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6810 -3.5630 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9080 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -0.2920 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.4960 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 1.7120 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 2.9080 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -1.6180 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -2.6360 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -3.8330 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2410 1.1070 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8010 -3.2580 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0440 -3.5480 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8860 -5.5330 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 -5.5830 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5910 -4.5870 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2600 -5.6630 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6670 -3.8620 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -3.0280 -2.6720 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END