NIH-ZINC03894723 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2190 -0.5500 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 0.7210 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.9580 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -2.0290 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -2.5010 -1.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -3.8000 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5780 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -4.2870 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -5.7880 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -6.2610 -4.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -7.7410 -4.8130 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -7.9190 -6.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -7.7940 -4.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -8.9570 -4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -9.5430 -4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -10.4710 -3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -10.6400 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -9.5920 -2.4500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.9480 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.5970 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 3.0240 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -2.2170 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.5580 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.8790 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -4.0980 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -3.7570 -3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -5.9760 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -6.3180 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -5.7070 -5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -9.3090 -5.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -11.0170 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -11.3190 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 M END