PUBCHEM-ZINC04775514 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 85 0 0 1 0 0 0 0 0999 V2000 1.1720 -1.3880 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.5470 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -0.8000 -0.3060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4400 -0.2890 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -0.2660 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.2560 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 1.7880 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 3.3030 -0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3160 3.5960 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 3.9610 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 4.6470 -2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6400 3.9370 -1.5080 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6530 2.9040 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 3.9010 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3210 3.1280 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7470 3.5670 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 4.7720 -0.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4510 5.6630 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 4.5680 -1.7890 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5370 3.9060 -2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 5.9320 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2240 6.4460 -2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2700 6.0660 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2380 5.0970 -0.9290 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0210 3.8490 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7930 4.0890 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5840 5.3910 -2.5880 C 0 0 3 0 0 0 0 0 0 0 0 0 12.1630 5.4740 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6370 6.5920 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5030 5.3900 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6430 6.0840 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8650 6.6720 -2.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6460 6.1280 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 5.7540 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 5.3070 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -2.3030 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.8360 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -2.5560 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -2.4370 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -1.0530 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -1.2740 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -0.8230 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 0.5100 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -0.7070 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -0.5300 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 1.6970 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 1.5200 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 1.3470 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 1.5240 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 3.1990 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 4.7030 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 4.4380 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 5.7150 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 3.2800 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 2.0500 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2880 3.7910 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 2.7200 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 5.8180 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 6.6260 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 7.1700 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7190 3.5910 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 3.0170 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4840 3.2570 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 4.1120 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5650 7.0830 -3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0040 7.3070 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3490 5.3020 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1880 7.0730 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1270 6.0420 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9090 5.0650 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 6.0000 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3850 6.6650 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 5.2440 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 5.7350 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 5.9400 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -2.8130 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -2.3260 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -3.9070 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.6560 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -2.1760 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -3.6270 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -2.0450 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 36 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 52 1 0 0 0 0 11 53 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 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 2 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 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