ANALYTICONDISCOVERY-ZINC04221551 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 75 0 0 1 0 0 0 0 0999 V2000 0.5330 -3.3900 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -2.2100 -0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.2260 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.9500 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.1000 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.9010 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.4410 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.2460 -3.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 0.8740 -2.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 1.3450 -4.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1510 0.6120 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.6540 -4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 2.7110 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 3.5210 -5.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 2.7130 -4.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4230 3.2040 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 2.5240 -4.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 2.7190 -5.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 4.7900 -5.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 5.3620 -5.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 5.4990 -6.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 6.9160 -6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 7.6240 -7.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 7.0530 -8.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 8.8940 -8.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 9.7030 -7.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 11.1730 -7.8410 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0850 11.4880 -7.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 11.0880 -9.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 9.6980 -9.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9250 9.8000 -8.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 9.0420 -10.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 8.2170 -10.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 12.0670 -7.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 12.5720 -6.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 12.3620 -5.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 13.3740 -6.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 13.7700 -8.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 14.5140 -7.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 14.5600 -6.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 13.8750 -5.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 13.6960 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -3.7270 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -3.1340 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -4.1860 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -3.1120 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -0.6430 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.9800 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.5080 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 0.7640 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 2.0710 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 2.2250 -6.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 3.3340 -5.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 4.9510 -7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 5.5500 -6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 7.4640 -5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 6.8650 -7.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 9.4950 -6.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 9.5040 -8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 11.8760 -9.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 11.1400 -10.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 12.2960 -8.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 13.5460 -9.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 14.9710 -8.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0930 15.0620 -5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 12.8280 -4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 14.5840 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 13.5420 -4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 2.1380 -3.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 9.3740 -11.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 8.9270 -12.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 2.0300 -4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 69 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 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 34 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 70 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 2 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 38 63 1 0 0 0 0 39 40 2 0 0 0 0 39 64 1 0 0 0 0 40 41 1 0 0 0 0 40 65 1 0 0 0 0 41 42 1 0 0 0 0 42 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 69 72 1 0 0 0 0 70 71 1 0 0 0 0 M END