IFLAB-ZINC04248032 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3880 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6910 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0120 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 1.4280 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 2.1020 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 2.1340 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.4190 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 0.0170 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -0.6370 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 -0.8910 -0.0590 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -2.5810 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -3.5590 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8580 -3.1540 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -4.8840 -0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5280 -5.7920 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -5.5080 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8010 -6.4060 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6220 -7.5870 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3990 -7.8720 -1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 -6.9800 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 -9.3540 -1.8990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.3370 -6.0520 0.9840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9080 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5500 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7710 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.1820 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 3.2140 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 1.9300 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -2.7400 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -2.7310 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 -5.2090 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8970 -4.5860 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4390 -8.2870 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -7.2050 -1.3480 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 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 22 1 0 0 0 0 21 35 1 0 0 0 0 M END