PUBCHEM-ZINC04830721 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 1 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 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -2.7430 -5.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9900 -1.8000 -5.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -3.2980 -6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -4.3860 -7.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -2.5870 -7.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -3.1270 -8.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9010 -4.2110 -8.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -2.7350 -9.7800 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4500 -1.8370 -9.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 -2.4760 -10.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1100 -1.7660 -10.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8320 -0.7210 -9.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -2.4780 -8.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3880 -1.7560 -7.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -3.4780 -8.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 -1.8680 -10.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7370 -2.8440 -11.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 -2.6250 -12.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 -1.4990 -11.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4400 -0.9970 -10.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 0.1190 -9.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8260 0.7510 -10.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 0.3190 -10.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 -0.7930 -11.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6590 -1.2360 -12.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -3.8860 -10.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -3.4640 -11.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -3.6980 -5.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.2670 -4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.0850 -4.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -4.1450 -3.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -3.6090 -3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 -4.7310 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -5.4020 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -6.4310 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -6.7900 -1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -6.1180 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -5.0860 -3.5500 C 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 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -1.8620 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -3.4570 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -1.7170 -6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -3.1260 -8.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -3.6750 -11.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9860 1.6550 -9.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 -2.0430 -12.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4910 -0.7400 -12.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -4.7350 -10.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -4.1810 -9.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -4.1450 -11.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -4.6420 -5.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -3.1180 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -2.8860 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -5.1220 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -6.9560 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -7.5940 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -6.3990 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -4.5600 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 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 51 1 0 0 0 0 5 6 1 0 0 0 0 5 52 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 67 1 0 0 0 0 41 68 1 0 0 0 0 42 43 1 0 0 0 0 42 47 2 0 0 0 0 43 44 2 0 0 0 0 43 69 1 0 0 0 0 44 45 1 0 0 0 0 44 70 1 0 0 0 0 45 46 2 0 0 0 0 45 71 1 0 0 0 0 46 47 1 0 0 0 0 46 72 1 0 0 0 0 47 73 1 0 0 0 0 M END