NIH-ZINC06530790 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -0.7310 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -1.8610 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -1.8820 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 -0.7740 -4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 0.3560 -3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 0.3790 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -0.0260 0.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 -0.2990 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -1.1090 2.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 0.4010 3.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4820 1.4770 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 0.0900 2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 0.8270 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 0.3420 4.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 0.5040 5.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -0.0880 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 1.3400 6.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 0.8690 7.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 1.2950 7.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 3.0280 6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 3.6000 5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 4.9150 5.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 5.5880 5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 5.1010 5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 3.9690 6.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -1.7290 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -2.7260 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -2.7650 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -0.7920 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 1.2210 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 1.2630 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 0.6220 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -0.9840 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 0.4150 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 0.6230 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 1.8990 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 -0.7100 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 0.9330 5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 0.2190 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -1.1750 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 3.1150 5.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 6.0330 5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 M END