PUBCHEM-ZINC00690221 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 73 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3300 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.5360 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 0.2840 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 1.8990 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -0.0930 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 0.8470 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 2.0230 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 0.4380 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8120 1.6340 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 2.2260 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0790 1.3520 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 1.6770 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 2.1900 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 1.7000 -2.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0590 3.4210 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 3.8450 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 5.0950 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 4.7870 -1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2630 4.3630 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3800 3.1140 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.8360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -1.7860 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -1.7880 -1.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -2.6340 -1.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -3.5580 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -4.4030 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 -5.9870 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -6.8310 -5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -7.8780 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -7.1690 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -6.3160 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9530 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -1.0330 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 -0.1600 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1680 -0.1510 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 3.2910 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 0.3370 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 1.8420 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 2.3800 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 0.8750 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 4.2290 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8530 3.0370 -3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 4.0640 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4230 5.3960 -3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 5.9020 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0570 3.9790 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1730 5.6770 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2040 4.1440 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7500 5.1710 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1800 2.8120 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8930 2.3060 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -1.4030 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -0.1820 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -2.6330 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -2.9910 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -4.2120 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -4.9700 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -3.7490 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 -5.2310 -3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -6.6300 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -7.3310 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -6.1860 -5.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -8.5470 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -8.4520 -5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -7.9110 -4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -6.5300 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -6.9570 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -5.7980 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -5.3290 -3.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 27 70 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 70 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 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 M END