IFLAB-ZINC02966260 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 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 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0740 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0480 -3.1490 -3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.8910 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -3.9640 -3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -4.0220 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -4.5900 -4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -3.8340 -4.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -3.6500 -4.4890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2220 -3.1630 -3.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -2.6000 -5.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.5600 -5.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.5960 -6.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.6690 -7.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -1.7130 -7.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -2.6750 -6.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -1.8000 -8.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -1.0300 -9.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 0.3850 -9.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 0.2830 -8.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -4.8860 -4.8800 O 0 0 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 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2710 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5170 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0190 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -2.9480 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -1.9040 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -4.9330 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4190 -3.7180 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -4.6630 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -3.0180 -5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -5.6400 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -4.4940 -6.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -2.3100 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -3.9730 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -1.5010 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 0.2160 -6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 -3.4850 -6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 -0.9810 -9.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -1.4900 -10.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 0.8420 -8.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 0.9890 -9.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -4.8170 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 17 46 1 0 0 0 0 17 47 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 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 28 55 1 0 0 0 0 M CHG 1 9 1 M END