NIH-ZINC04035090 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6890 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.0080 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.7180 3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.1060 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.7940 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0940 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.8010 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0600 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6580 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0160 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1530 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.7560 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -6.2560 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -6.7590 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -7.0380 -2.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -8.5040 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -9.0460 -3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -7.0670 -4.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -6.4480 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -9.1660 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -8.8090 -6.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -7.6770 -7.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -7.3460 -8.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -8.1470 -9.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -9.2870 -8.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -9.6160 -7.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -9.9000 -9.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -9.3510 -11.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -8.0460 -10.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.0710 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1890 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -2.6460 4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.8740 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5540 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -4.4560 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.4310 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -8.7860 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -8.9120 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -8.7210 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -10.1360 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -6.7250 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -6.7650 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -6.6630 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -5.3700 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -10.2490 -5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -8.8100 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -7.0510 -6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -6.4610 -9.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -10.5020 -7.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -9.9610 -11.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -9.2690 -11.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -8.5350 -4.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 11 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 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 21 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 57 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 57 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 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END