PUBCHEM-ZINC05821769 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 80 0 0 1 0 0 0 0 0999 V2000 3.5330 0.7060 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -0.7710 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -0.9840 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.4760 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -2.7800 -1.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5770 -2.3230 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -2.1460 -2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -2.3950 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -4.3100 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -6.1200 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -6.3490 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -7.8400 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -9.4670 1.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0390 -9.9260 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 -9.4350 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -8.5690 3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -7.6200 3.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -8.9470 5.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 -8.1400 6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -8.7180 7.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9120 -9.7830 7.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -7.9720 8.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -8.6150 7.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 -9.0680 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -10.1560 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -11.6800 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -12.4780 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -11.8940 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9250 -12.1700 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -13.6320 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -13.9780 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 0.8350 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 1.2340 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 1.1780 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 -1.2200 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -1.2740 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.5370 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -0.4630 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -2.8990 -2.6450 H 0 0 0 0 0 0 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0 -4.6200 -8.0360 8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4330 -9.5930 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 -10.0360 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -12.1610 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 -13.5480 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -12.3580 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0880 -11.3890 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -12.9570 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4060 -11.5200 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 -11.5290 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -12.0150 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -14.3090 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3430 -13.8180 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -13.3460 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -13.8440 -3.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5400 -15.0220 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -4.6510 -0.7110 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4030 -4.2650 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -4.1670 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -8.0240 1.2170 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4580 -7.5190 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -7.5580 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 9 76 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 10 76 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 12 79 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 13 79 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 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 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 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