IFLAB-ZINC04263060 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -2.5200 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -4.3310 -2.4920 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -4.6250 -4.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -6.1090 -4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -6.8900 -3.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -6.5670 -5.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -7.9350 -5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 -8.4790 -6.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 -9.7980 -6.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -10.3970 -5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -9.1450 -4.5210 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -2.4910 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.5070 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.1330 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.1170 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -4.1850 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -4.1690 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -5.9420 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -10.3480 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -11.4630 -5.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 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 26 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 M END