NIH-ZINC04102008 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8120 -1.5830 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.1030 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.9090 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -0.3240 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 0.9570 -4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 1.4930 -3.2140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -0.3460 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.3520 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 0.0820 -1.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 0.5100 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -0.1860 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.3640 2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -1.1660 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -1.5010 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -1.9780 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 -2.1260 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -1.7990 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -1.3230 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -1.0060 3.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 -1.1920 4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.9400 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -0.8630 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.5730 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -0.0960 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -1.4250 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -0.0220 -3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 1.4280 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 0.2500 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 1.5900 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -1.2620 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1800 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -1.3870 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -2.2370 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 -2.5000 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9330 -1.9170 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -0.9010 5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -0.5750 4.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -2.2400 4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.1070 -1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 49 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 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END