NIH-ZINC04039035 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0240 -0.8270 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1280 0.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.3320 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.4840 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.4450 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2410 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0570 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7730 -1.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.4170 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 0.1960 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 0.4970 2.2890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2710 1.1690 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 1.1440 3.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 1.2380 4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 1.7270 5.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 0.6620 4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.6030 5.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 1.6110 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 3.0630 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 4.9840 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 5.4370 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 4.7060 0.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 3.2880 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 2.8130 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -0.7830 1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9690 -1.1520 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -2.3370 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -3.1060 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.7240 2.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -1.6000 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.6180 3.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.3690 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -5.4340 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -5.3630 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.1990 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 1.5470 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 0.9880 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 3.1270 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 3.6870 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 5.4970 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 5.2210 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 6.5030 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 5.2500 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4960 2.8000 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 3.0380 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 3.0140 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6200 1.7420 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -0.5310 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -2.6560 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -4.0310 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -1.3170 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.3040 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 3.5320 2.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 58 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 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 M END