NIH-ZINC00424564 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.1440 1.6070 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.0840 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4530 -0.1920 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -0.4310 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -1.9570 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.5510 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -1.9750 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.0630 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -0.2990 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 0.2760 -1.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 -0.4450 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 -1.5610 -2.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 0.1600 -3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0870 -0.5120 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 0.1360 -5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 1.4110 -5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 2.0270 -4.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 1.4550 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 2.1020 -2.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2160 2.9950 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 1.5060 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 2.3580 -0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.0430 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.9860 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.8780 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 0.0000 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -0.1440 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.2430 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.3310 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -3.6340 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.2970 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -2.2400 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -2.3850 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.3360 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 1.1470 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -1.3830 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 0.1010 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -1.5070 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -0.3480 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0250 1.9130 -6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.5130 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 M END