IFLAB-ZINC04553835 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -0.2970 -2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -0.2740 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -2.2400 -1.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.9400 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -4.4310 -1.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2770 -4.5620 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -5.1510 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -5.8420 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -6.4200 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -6.1980 -1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -5.2150 -0.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -5.1130 -0.3250 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -4.5880 -0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -5.1290 0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -6.8140 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -7.2200 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -8.5550 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -9.4840 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -9.0790 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -7.7440 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.7440 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.8090 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.5310 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -5.9430 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -7.0060 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -6.5680 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -6.4940 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -8.8720 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -10.5280 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -9.8050 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -7.4280 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END