PUBCHEM-ZINC04574659 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 68 0 0 1 0 0 0 0 0999 V2000 -0.4280 0.9690 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -0.5450 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -1.2600 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -0.9590 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.9030 -1.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -0.5580 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -0.9860 -2.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3670 -0.8040 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -2.4540 -3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -2.8170 -4.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -3.3580 -2.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -4.7540 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -5.1390 -3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -5.6280 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -4.9660 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.2130 -3.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 1.0040 -4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 1.4600 -3.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 1.8000 -5.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6250 1.9870 -5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 1.0120 -6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 0.8200 -6.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 1.2040 -6.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 0.2230 -8.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 3.0770 -5.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 4.1530 -6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 4.0430 -6.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 5.3500 -6.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 6.4650 -6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 7.7120 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 8.0360 -7.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 9.1800 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 10.0000 -6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 9.6770 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 8.5350 -5.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 1.2640 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.4790 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 1.2420 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -0.9870 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.3390 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.9660 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -0.4490 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -2.0370 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -0.6860 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 0.5200 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -1.0680 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -4.9880 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -6.1870 -4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -4.5160 -4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -5.3540 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -6.6760 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -5.4770 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -4.3430 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -6.0140 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -4.6920 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -0.5760 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 0.0390 -6.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 1.5620 -7.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -0.0830 -8.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 0.1000 -8.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 3.1480 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 6.2480 -7.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 6.6160 -6.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 7.3960 -8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 9.4340 -8.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 10.8940 -6.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 10.3170 -4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 8.2840 -4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 53 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 34 2 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 67 1 0 0 0 0 35 68 1 0 0 0 0 M END