IFLAB-ZINC04280216 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.1990 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0000 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4040 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.8450 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 3.0860 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 3.3070 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 4.5480 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3750 4.9880 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 4.3030 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7740 5.0110 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7550 6.3960 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 7.0860 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3530 6.3930 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 6.8340 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 5.8020 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 5.8810 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 0.5910 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 0.5120 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -0.4410 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -1.7730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 3.2230 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7160 4.4850 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 6.9430 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 8.1660 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 7.7670 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -1.3740 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 32 1 0 0 0 0 M END