CHEMBRIDGE-ZINC02906306 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8360 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -4.1710 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -4.8480 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -6.3680 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -7.0450 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -8.4640 1.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -9.2200 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -8.6080 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -9.3790 4.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -10.7580 4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -11.3700 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -10.6040 2.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -11.2590 1.6020 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6890 -12.4740 1.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -10.5830 0.7140 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1420 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.3120 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -3.6840 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -4.4830 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.4590 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.5370 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -4.5600 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -6.6790 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -6.6560 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -6.7330 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -6.7570 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -7.5310 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -8.9030 5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -11.3590 5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -12.4480 3.7130 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 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 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END