IFLAB-ZINC02457731 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.9460 1.2190 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -0.2410 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -0.8960 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.2470 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -2.9450 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.2980 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -0.9480 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -4.6450 0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -4.8900 -1.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -4.8810 1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -5.5130 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -5.4690 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -6.6120 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -6.5650 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -6.5410 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -5.4120 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -6.5520 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -6.5680 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -6.4750 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -5.5790 -2.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0320 1.8190 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 1.4610 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 1.4980 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -0.3540 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.7390 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.8270 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -0.4510 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -4.5050 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -5.5880 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -6.5910 -2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -7.5770 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -6.4260 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -7.5140 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -5.4970 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -4.4400 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 -7.3080 -1.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 2 0 0 0 0 M CHG 1 20 -1 M END