IFLAB-ZINC04086583 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.3810 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 0.4820 -2.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 0.0350 -3.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -1.2540 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.9960 -2.1040 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -1.9300 -4.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -1.2360 -5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 -0.0230 -5.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -1.9680 -6.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -0.9690 -7.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -0.5010 -7.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 0.4150 -8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 0.8620 -9.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 0.3940 -9.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -0.5260 -8.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -2.8990 -4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -2.5860 -6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -2.6000 -7.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 -0.8510 -6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 0.7810 -8.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 1.5780 -10.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 0.7440 -10.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.8940 -8.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 M END