IBS-ZINC03882900 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 0.0020 1.4940 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0130 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.7180 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -2.1000 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -2.7770 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.0730 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.6900 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.5390 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -4.9200 -1.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.9480 1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -5.0480 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -5.2630 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -4.4570 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -4.8330 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -4.4860 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -5.2980 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -4.0680 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -3.2970 -0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4950 -4.2390 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7570 -3.4940 1.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6000 -2.5030 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 -4.2430 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3690 -4.2700 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6090 -5.1580 -2.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.9290 -5.0840 -3.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -3.3610 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5970 -3.8410 3.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -2.7090 2.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8930 -2.6690 4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0190 -2.6020 5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5130 -2.5620 6.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8830 -2.5890 6.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7570 -2.6560 5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2640 -2.6900 4.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3690 -2.5500 7.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7900 -2.5810 8.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 1.8680 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.8620 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.8410 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.1890 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.6510 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.6020 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.1400 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -4.9280 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -6.3230 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -3.3920 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -4.6830 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -5.9030 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 -3.4210 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -4.7330 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -6.3600 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -4.9860 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 -4.8550 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8960 -5.2650 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7640 -3.7370 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 -3.2480 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -4.7760 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8220 -4.0420 -4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9530 -5.5700 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 -5.5950 -4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8730 -2.2680 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9530 -2.5810 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8340 -2.5100 7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8230 -2.6780 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9440 -2.7380 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0430 -2.5440 9.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2280 -1.7220 7.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1820 -3.5000 7.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 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 23 57 1 0 0 0 0 24 25 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 35 36 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 M END