NIH-ZINC02857737 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 2.7730 0.6300 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.5820 0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.9400 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -0.3220 -1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -2.2030 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.8300 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -4.0170 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.5820 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -3.9690 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -2.7800 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -2.1330 -3.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -2.5700 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -3.7140 -4.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -1.6120 -5.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -2.0640 -6.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -1.3480 -7.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 0.6070 -6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -0.1570 -5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 0.9100 -8.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 2.3130 -8.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 2.6880 -9.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 4.0650 -9.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 4.5110 -11.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 5.8030 -11.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 6.6580 -10.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 6.2230 -8.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 4.9300 -8.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 0.5340 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 1.4710 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 0.8150 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.4070 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.4980 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -5.5050 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -4.4470 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -1.2520 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -1.8480 -6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -3.1460 -6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -1.6200 -8.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.5660 -7.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 0.4140 -6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 1.6810 -6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 0.1350 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 0.1210 -5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 0.8890 -8.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 0.3530 -9.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 3.0530 -8.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 1.9590 -10.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 3.8590 -11.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 6.1420 -12.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 7.6630 -10.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 6.8870 -7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 4.6110 -7.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 0.1580 -7.6490 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7520 0.3650 -7.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 53 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 46 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 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END