IFLAB-ZINC04194853 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 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 0.8450 -0.4970 1.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.5200 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.3990 -1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -1.6490 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -2.0020 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -3.3410 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -3.6630 -4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -2.6630 -5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -1.3330 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -0.9980 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -2.6440 -0.8730 N 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 1.5390 -4.1230 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -4.6990 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.9200 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -0.5560 -5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 0.0400 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.4130 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -3.5750 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 M END