NIH-ZINC06549644 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -3.9160 2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.4980 3.6560 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2380 -4.0790 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -5.9960 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -6.7100 4.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -6.5370 2.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -7.9870 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -8.4160 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -4.1620 4.8750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -4.1030 6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -4.3290 6.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -3.7650 7.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -3.7030 8.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -3.3870 9.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -3.1280 9.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -3.1890 8.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.4990 7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.8100 10.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -2.5370 10.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -3.7620 10.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -4.1300 12.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -3.5100 13.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -5.4160 12.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -6.2550 13.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -7.4230 12.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -7.7560 11.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -6.9280 10.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -5.7560 10.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -4.6630 10.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -4.5920 8.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -4.2660 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -4.2400 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -8.3760 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -8.3810 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -9.5040 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -8.0260 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 -8.0220 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -3.9820 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -3.9040 8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -3.3400 10.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -2.9880 8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -3.5420 6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -2.7670 11.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -1.7650 11.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -2.1950 9.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -5.9990 14.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -8.0770 13.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -8.6700 10.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -7.1930 9.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 35 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 M END