PUBCHEM-ZINC03782558 MOE2007 3D CORINA 3.40 0006 02.08.2006 83 84 0 0 0 0 0 0 0 0999 V2000 0.0110 1.8360 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 0.3390 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -0.8980 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.3430 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.4610 5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 0.7340 5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 2.2300 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 3.4610 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 2.9600 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 2.1320 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 2.7270 4.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 2.6710 3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 2.9920 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 4.3920 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 4.9230 2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 6.4230 3.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 7.6290 5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 7.1020 6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2260 5.8730 8.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6370 5.3320 8.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 3.8300 7.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 2.5780 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 3.0930 4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 2.1260 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 2.4000 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -0.1510 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.0930 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -1.2110 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -1.7520 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 0.7380 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -0.7970 3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 0.2030 6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.3520 4.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 0.4220 6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 0.1740 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 2.6990 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 2.6860 5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 4.3570 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 3.6960 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.4520 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 1.8820 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.2550 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 2.3780 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 1.9980 5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 3.7260 5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 1.6720 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 3.4000 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 3.9190 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 2.1800 5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 4.1960 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 5.1340 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 4.7520 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 4.4030 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 6.7150 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 6.9780 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 8.6220 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 7.6850 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 7.7410 7.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 6.0850 6.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 5.1300 7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 6.0860 9.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0840 5.8410 7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2460 5.5070 8.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 3.2780 8.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5430 3.5550 7.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 2.5170 5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 1.5890 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4160 4.0910 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6380 2.4200 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 0.1450 0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 1.0120 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -0.6560 4.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -1.5090 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 2.4180 4.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 3.2670 0.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 3.5380 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6710 3.1470 3.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 6.7220 4.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 7.1020 4.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 7.1070 7.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 7.2440 6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4550 3.5000 6.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7660 4.3360 6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 70 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 70 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 72 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 72 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 74 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 74 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 75 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 75 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 74 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 13 77 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 77 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 16 78 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 17 78 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 18 80 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 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