IFLAB-ZINC04393846 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -5.2680 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -4.4660 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 -4.8360 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -4.4790 1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2850 -3.4140 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -5.2880 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 -4.8140 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -5.6140 3.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -4.2250 2.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -4.9370 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -6.3290 -1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -3.4000 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -4.6980 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -4.2850 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -5.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -6.3500 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -4.9690 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 -3.5860 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -4.4410 3.5120 H 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 17 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 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 M END