NIH-ZINC06499021 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 -0.4110 1.9520 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.4560 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.0640 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -1.5600 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -2.0580 2.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.5240 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.5370 3.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -3.0200 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -3.5130 5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -3.4240 5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -4.0740 6.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -4.4790 8.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1460 -4.8440 7.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -5.5920 8.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -6.8180 7.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -7.8600 8.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -8.7850 7.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -9.6220 6.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -8.3500 6.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -7.0960 6.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -6.4060 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -6.9510 5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -8.1860 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -8.8880 5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -3.2960 9.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -2.2250 8.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -3.4330 10.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.2520 11.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -2.9660 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -3.3570 5.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -2.4720 3.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -2.0430 2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 -1.6140 1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 2.4850 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 2.3220 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 2.1170 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.0760 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 0.2910 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 0.4690 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1010 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.0930 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -1.7250 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -4.0550 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -3.7610 6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -2.3900 5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -4.2090 6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -5.2580 9.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -5.8320 9.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -7.9540 8.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -5.4450 6.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -6.4170 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -8.6040 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -9.8470 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -1.8990 11.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -1.4700 10.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -2.5000 12.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -2.4300 3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 M END