NIH-ZINC04057081 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -1.1210 0.8690 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -0.3610 -0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.5050 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.7240 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -1.9990 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -1.0700 -2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 0.1500 -2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 0.4350 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.3330 -3.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -0.8140 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -1.9080 -6.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 -3.1540 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -2.0590 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -3.6160 -6.7870 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2360 -4.3870 -6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -4.2510 -6.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 -5.1820 -7.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -6.3410 -7.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 -6.6760 -7.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -7.1840 -8.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 -8.5670 -8.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1490 -9.4010 -9.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8640 -8.8550 -10.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 -7.4740 -10.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 -6.6310 -9.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9080 -6.8010 -12.1360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -3.0450 -8.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -3.5470 -9.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -3.0320 -10.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -2.0240 -10.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 -1.5140 -9.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -2.0330 -8.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.7120 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 1.0150 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 0.8230 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -2.4720 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -2.9770 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.9250 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 1.4030 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -0.4420 -5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 0.0260 -5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -2.7030 -6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -1.4560 -7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -3.5720 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -3.9450 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -1.3400 -3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 -2.5120 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -3.4790 -6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 -4.8180 -5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 -4.9750 -7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -9.0040 -7.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -10.4750 -9.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2670 -9.5090 -11.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 -5.5560 -9.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -4.3490 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -3.4110 -11.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -1.5880 -11.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6710 -1.5900 -7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 -2.5700 -5.7400 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2630 -1.8280 -5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 12 59 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 14 59 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END