NIH-ZINC04041202 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 0.4580 1.7540 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 1.4110 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 1.0230 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 1.0050 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 1.3390 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 1.7200 -1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 1.1930 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 0.7760 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 0.6720 0.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 0.5430 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 1.6110 -0.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -0.6160 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -1.8880 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0800 -2.9660 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8150 -4.1520 0.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 -2.3480 0.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 -0.8880 0.5330 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8080 -0.5660 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 -0.2450 1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5410 0.9120 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0240 1.4750 2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7190 0.8810 4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9350 -0.2590 4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4560 -0.8340 2.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -3.0650 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -3.1630 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 -3.9120 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1000 -5.1370 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6020 -5.3140 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0670 -4.0710 -4.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0190 -3.1000 -4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4830 -2.8020 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -2.1100 0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 2.0500 -1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.4440 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 0.7530 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 1.9830 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 1.3720 -2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 1.3790 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6290 2.3780 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 1.2990 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6630 -0.7580 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2690 -2.5560 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4010 -4.0720 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4200 -3.6710 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 -2.1540 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2310 -3.3880 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3210 -4.9150 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6880 -6.0720 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8950 -4.7680 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4420 -6.0160 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8190 -5.7200 -4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4320 -2.1870 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2220 -3.4560 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2700 -2.4070 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6450 -2.1040 -2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 2.4060 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9860 -4.0930 -2.2270 N 0 3 0 0 0 0 0 0 0 0 0 0 11.2180 -4.4630 -2.8040 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END