IFLAB-ZINC02458678 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 1.2540 -0.3990 -4.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.5500 -3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -0.9210 -2.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -0.6160 -1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.0060 -2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -2.2270 -1.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -2.8060 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.0160 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -4.5550 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -3.8610 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -2.7180 -0.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 -2.1830 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -5.8380 -2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -6.4330 -3.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.3580 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 0.0430 -4.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.7770 -5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -1.9920 -4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.3070 -4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.5900 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -4.5260 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -4.2670 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -1.2450 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -6.3470 -2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -7.1880 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 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 21 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 24 25 1 0 0 0 0 M END