NIH-ZINC06467783 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.0290 -0.7640 1.3030 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 -0.1090 1.2040 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -0.6660 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -2.1360 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -2.6240 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -1.8900 -3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.4210 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 0.0680 -2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -2.7040 -4.8310 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -1.8060 -5.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.9820 -4.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -2.9830 -5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -2.0470 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -2.2590 -6.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -3.4040 -6.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -4.3520 -5.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -4.1350 -5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 -5.5810 -5.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -6.4050 -4.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 -5.7900 -5.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0540 -6.9410 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -7.9300 -4.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -7.9510 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -8.8990 -4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -10.1130 -3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7710 -10.8680 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -10.4200 -4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7880 -9.2180 -5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -8.4410 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2730 -7.2400 -5.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -1.1220 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -1.6130 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.1060 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -2.4800 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.5230 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -3.6920 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -2.4360 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.0340 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -0.0760 -2.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 1.1350 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.1170 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -1.1480 -6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -1.5250 -7.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -3.5680 -6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -4.8660 -4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8010 -5.1330 -6.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -10.4680 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8320 -11.8130 -3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7460 -11.0200 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6310 -8.8760 -5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 M END