IBS-ZINC04424042 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 1.5200 -0.9110 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -2.3040 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -2.2330 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -3.6260 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -3.5550 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -4.9480 -1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -4.8770 -3.3080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4220 -3.8230 -4.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6230 -2.8440 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -3.8000 -5.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8070 -3.5380 -5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -6.1460 -5.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4080 -5.8730 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -6.2400 -3.9620 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6900 -6.9860 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -6.6420 -3.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -8.1680 -3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -8.5700 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -7.4800 -6.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -8.4340 -6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -9.6580 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -9.9280 -7.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -8.9740 -7.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -7.7520 -6.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -2.7780 -6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -1.5300 -6.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.5930 -7.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.9030 -7.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -2.1520 -7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -3.0900 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.1720 -3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 -4.5230 -3.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -0.5530 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.2260 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.9610 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -2.9890 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -2.6620 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.5480 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -1.8750 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -4.3110 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -3.9840 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -2.8700 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -3.1970 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -5.6330 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -5.3060 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -6.2380 -2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -6.2460 -4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -8.5660 -4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -8.5710 -2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -8.1680 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -9.6580 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -8.1730 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -8.2230 -5.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -10.4030 -6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -10.8830 -7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -9.1850 -7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -7.0080 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -1.2880 -6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 0.3820 -7.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.1710 -7.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -2.3940 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -4.0670 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -4.6740 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -3.2580 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -4.8320 -4.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -3.6680 -3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -5.1260 -6.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -5.3760 -6.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 67 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 12 67 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 67 68 1 0 0 0 0 M END