IFLAB-ZINC04315642 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3700 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 1.2640 -0.5270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 0.7880 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.9550 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -1.9560 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.7850 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -2.3510 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -3.7790 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -3.9530 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -5.7170 -0.0760 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8940 -5.6270 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -6.6910 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 -7.6280 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -6.1780 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 -4.8250 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 -4.5210 -0.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2880 -6.9520 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5170 -6.2910 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6890 -7.0180 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6480 -8.4030 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4300 -9.0650 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2520 -8.3480 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7980 -9.1110 -0.1750 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9380 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.6100 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 3.0220 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -1.6900 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -4.2530 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -4.2440 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -3.4790 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -3.4880 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 -4.1170 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5510 -5.2110 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6410 -6.5080 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4040 -10.1450 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -8.8650 -0.1200 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 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 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END