CHEMBRIDGE-ZINC00545280 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5270 -1.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -0.3320 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -1.1710 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 -0.8120 2.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 -1.4040 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -2.3080 3.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 -0.7720 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6940 -0.9620 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -0.1760 6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3290 0.7940 5.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0350 0.9950 4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 0.2170 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5130 0.1500 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 0.8480 1.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -0.3270 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -1.1720 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -0.3960 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 0.8770 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 0.9140 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 0.7260 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -0.5250 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -2.2280 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -0.9780 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1770 -1.7190 6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -0.3230 7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0820 1.4010 6.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 1.7560 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -2.2380 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -0.7550 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 1.7260 -3.2700 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M END