NIH-ZINC04039838 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 -2.6800 2.2070 -2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 2.1220 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 0.8120 -3.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 0.5900 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 1.4190 -5.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -0.7630 -4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -1.4460 -5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -2.7680 -5.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.8480 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.6390 -3.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -1.4010 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.9720 -3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -3.8880 -5.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -3.6230 -6.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3000 -4.3220 -5.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0940 -3.5660 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -5.2380 -6.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -5.1970 -7.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -5.8300 -8.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -4.1780 -7.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -3.8690 -8.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 -6.0130 -6.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 -7.5030 -6.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 -9.7940 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -7.9770 -7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -4.9400 -4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -6.2560 -4.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -6.8350 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -6.1120 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -4.7880 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 -4.1940 -3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -2.8890 -3.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -1.9400 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -4.0250 -0.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 -4.5870 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -5.0370 -5.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -0.8990 -7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 1.4450 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 2.0200 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 3.1930 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 2.2890 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 2.8760 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -4.4000 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -3.6410 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -4.7600 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8320 -5.5530 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -5.8970 -5.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -7.9260 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -7.6670 -8.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -10.0590 -7.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -10.0030 -5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 -10.3290 -6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 -6.9340 -7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 -8.1460 -8.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 -8.6220 -6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -6.8360 -5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -7.8550 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -6.6140 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -2.2950 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -1.6620 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -1.0410 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -4.8390 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -5.4580 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -3.8310 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -2.5510 -6.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -0.3610 -6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.6950 -7.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.2140 -7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 -8.3140 -6.5010 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3070 -8.1040 -5.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 36 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 65 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 69 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 69 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 69 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 69 70 1 0 0 0 0 M CHG 1 69 1 M END