NIH-ZINC04039270 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 2.7450 1.2990 3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 1.8240 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 1.0750 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 1.9890 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 3.2220 3.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 4.0810 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 3.1550 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 4.3100 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 4.2970 4.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 5.4370 4.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 6.6450 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 1.8040 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.3360 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -1.3520 3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -2.7840 3.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5090 -3.0880 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -3.4930 4.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -2.6260 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -2.8870 6.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -1.2530 5.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.1610 5.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -4.9440 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -5.5320 4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -7.4510 5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -8.8960 6.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -9.7490 5.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -9.3640 4.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -7.9410 4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -3.1540 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -3.8310 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -4.0120 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -3.4690 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -2.7400 2.5690 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -0.7000 1.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 1.9430 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 1.2470 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 0.3010 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 6.6070 5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 6.8200 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 7.4730 4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 0.9250 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 2.6700 3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 1.6630 1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -5.1780 5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -5.3720 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -5.5160 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -4.9740 5.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -6.7850 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -7.3630 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -9.2590 6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -8.9790 7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -10.0660 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -9.4600 5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -7.8540 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -7.6300 4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -4.1760 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -4.5090 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 -3.4580 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -0.4780 6.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -6.9770 5.3480 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5500 -7.0080 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 34 2 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END