IBS-ZINC02123019 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1400 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4820 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -1.8660 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.6300 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0040 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -3.9870 2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -4.7060 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -2.4970 4.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -1.6940 5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -2.6060 6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -2.9310 6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -3.7860 7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -4.0690 7.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -4.2970 8.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -4.0150 8.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -3.1620 7.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.8620 7.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -3.4010 8.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -4.2450 9.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 -4.5540 9.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -4.6380 10.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -4.3630 9.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.2710 8.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.2180 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1100 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.5930 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -5.7760 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -4.4570 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -4.4310 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -3.4660 4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -1.0520 4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -1.0780 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -2.5350 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -2.2090 6.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -5.2060 10.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -5.2320 9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -4.0640 10.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 33 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 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 39 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 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END