CHEMSTAR-ZINC04017878 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 87 0 0 0 0 0 0 0 0999 V2000 0.3340 0.8420 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -0.3920 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -0.9260 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -0.2280 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 1.0230 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 1.5510 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 1.7720 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 1.2750 -0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 1.9720 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 1.3160 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 2.0130 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4970 3.3820 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 4.0380 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 3.3400 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 4.1350 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8140 3.5650 -0.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 5.4540 -0.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9430 6.1910 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1070 7.3460 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2720 8.0760 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2880 7.6540 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1210 6.4930 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9520 5.7710 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5390 8.4330 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6000 8.1160 0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6630 7.3520 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5640 9.0880 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0350 9.9850 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8030 9.5300 -1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7920 11.0910 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0360 11.2930 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5640 10.4060 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8290 9.3040 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4890 8.2010 1.7760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.8410 10.6280 0.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 20.2720 11.8870 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5880 12.8310 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5760 12.1200 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0230 13.4270 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2300 13.6430 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0180 12.5570 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5700 11.2500 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3610 11.0350 1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2240 12.7730 3.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 25.5560 12.0890 4.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8550 12.3210 5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2150 11.5900 6.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4340 11.8130 6.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3060 12.7580 6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 28.9640 13.4860 5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7440 13.2730 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 27.4090 13.9850 3.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -0.7520 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.2530 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -0.9400 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -1.8890 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 2.5130 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 2.7350 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 0.2590 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 1.5070 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 5.0950 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 3.8460 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9390 5.8920 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3210 7.6720 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3990 8.9720 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9050 6.1640 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8200 4.8760 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3930 11.7840 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6160 12.1480 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4150 9.8760 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4150 14.2650 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5760 14.6520 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 24.1780 10.4120 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0130 10.0260 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 24.8760 11.3520 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 26.5380 10.8530 6.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 28.7110 11.2490 7.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 30.2600 12.9260 6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 29.6500 14.2210 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 26.9470 14.8120 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.5090 -2.1610 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 54 1 0 0 0 0 2 3 2 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 56 1 0 0 0 0 4 5 2 0 0 0 0 4 53 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 57 1 0 0 0 0 7 8 2 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 60 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 61 1 0 0 0 0 14 62 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 64 1 0 0 0 0 20 21 1 0 0 0 0 20 65 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 33 2 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 30 31 1 0 0 0 0 30 68 1 0 0 0 0 31 32 2 0 0 0 0 31 69 1 0 0 0 0 32 33 1 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 35 70 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 71 1 0 0 0 0 40 41 1 0 0 0 0 40 72 1 0 0 0 0 41 42 2 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 42 73 1 0 0 0 0 43 74 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 45 75 1 0 0 0 0 46 47 1 0 0 0 0 46 51 2 0 0 0 0 47 48 2 0 0 0 0 47 76 1 0 0 0 0 48 49 1 0 0 0 0 48 77 1 0 0 0 0 49 50 2 0 0 0 0 49 78 1 0 0 0 0 50 51 1 0 0 0 0 50 79 1 0 0 0 0 51 52 1 0 0 0 0 52 80 1 0 0 0 0 53 81 1 0 0 0 0 M END