NIH-ZINC06492317 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.6160 -4.5800 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.6700 -5.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.9100 -4.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.8480 -5.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.8200 -6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -2.4640 -8.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -3.6660 -8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -4.7040 -7.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8020 -5.0140 -7.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -4.0890 -5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -5.9020 -7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -6.2330 -6.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -6.6070 -8.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -7.7720 -8.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -8.3760 -9.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -9.3620 -10.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -9.8940 -11.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -9.4730 -12.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -8.5370 -12.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -7.9630 -10.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -1.4090 -6.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -1.0260 -6.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.7350 -8.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -2.7940 -8.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -3.3390 -8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -4.1110 -9.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -4.7900 -5.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -3.8660 -5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -6.3420 -9.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -8.5100 -7.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -7.4620 -8.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -9.7110 -9.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -10.6630 -11.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -8.2180 -12.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -7.2000 -10.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END