NIH-ZINC04271842 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7720 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0790 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0080 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.7810 -3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.9710 2.7100 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -4.2450 2.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -2.0860 3.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -3.2390 3.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -4.4540 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -2.2620 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -1.3230 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -1.4570 1.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -0.3340 3.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 0.5940 2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 0.6430 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -0.0760 5.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -0.1570 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 1.1960 5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8520 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6170 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.3980 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.4220 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.1140 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -5.2450 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -4.2510 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -4.7700 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -2.7820 4.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -1.6930 4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 1.5880 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 0.2410 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 1.4070 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -0.3270 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 -1.0350 5.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 0.1640 6.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -1.0060 5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 0.7640 5.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 0.2950 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7360 2.0250 4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 1.4350 6.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 0.9700 4.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 49 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 48 1 0 0 0 0 23 49 1 0 0 0 0 M END