CHEMBRIDGE-ZINC04954835 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7720 -2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -3.9480 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -4.2800 -4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -3.2600 -4.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -2.3860 -3.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -5.4630 -4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -6.2090 -3.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -5.8570 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -4.7620 -1.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -5.8390 -5.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -7.1030 -6.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -7.5250 -7.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -6.4640 -8.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -5.2010 -8.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -4.7790 -6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -6.8450 -9.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -5.9800 -10.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -6.3590 -12.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -7.5980 -12.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -8.4620 -11.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -8.0910 -10.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -8.0010 -13.8640 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7500 -7.2410 -14.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -9.0920 -14.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1650 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8530 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1420 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -3.2140 -5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -6.4940 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -6.9660 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -7.8750 -5.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -8.4460 -7.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -7.6880 -7.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -4.4290 -8.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -5.3380 -8.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -3.8570 -6.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -4.6160 -6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -5.0110 -10.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -5.6870 -13.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -9.4290 -11.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -8.7680 -9.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END