NCID-ZINC05606522 MOE2007 3D CORINA 3.40 0006 02.08.2006 77 80 0 0 1 0 0 0 0 0999 V2000 2.0820 0.2470 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -0.8210 -0.5790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4320 -1.7970 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.8380 0.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4070 -0.6620 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.1990 1.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5470 -2.9810 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.2120 3.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3900 -1.5250 3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -3.6050 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.3650 3.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -4.0030 3.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -3.2840 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -3.9720 4.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -5.1710 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -5.2100 4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -6.2920 4.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -7.3250 5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -7.3320 5.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -6.2880 5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -6.3050 5.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -7.5690 5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 -5.1550 6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -8.7380 5.8180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -8.1910 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -1.7980 3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -1.1670 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -0.9670 5.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 -0.7170 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -0.0620 6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 0.3550 6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.1260 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 -0.5220 4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 -0.9500 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -1.2190 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -2.9730 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.2040 1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.4160 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.5960 1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 2.5250 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 3.7820 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 4.8130 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 4.6040 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 3.3600 3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 2.3220 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.5220 -0.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 0.0180 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 0.2590 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 1.2230 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -2.2940 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -7.6890 6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -7.5560 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -8.3990 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -4.2310 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -5.1930 6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -5.1880 7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -7.2840 5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 -8.9730 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -7.9860 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.1180 6.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 0.8620 7.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4810 0.4550 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1740 -0.6970 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -1.4600 3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.4450 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.8750 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -1.4310 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -4.0150 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.3920 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -2.9070 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 3.9460 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 5.7850 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 5.4140 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 3.2040 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 1.3540 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.5660 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.4410 1.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 46 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 77 1 0 0 0 0 8 9 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