IFLAB-ZINC04170047 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.0320 1.1970 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.3320 -1.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2450 -0.7060 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.8390 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -1.4060 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -1.8710 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -1.7690 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -1.2010 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -0.7320 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.8030 -0.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -1.0170 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.9340 -2.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -1.2000 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -1.4680 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -1.3510 -1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -1.5480 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -0.2760 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -0.0580 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 1.1090 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 2.0570 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 1.8400 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 0.6700 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.3920 1.5070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -1.7820 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -2.0200 -2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -1.8160 -4.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 -2.0320 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -1.5560 -5.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -1.5950 -6.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -1.2510 -4.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 -0.9730 -5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.5480 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.5640 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.5700 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.4870 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -2.3150 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -2.1320 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -1.1210 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.2850 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.9640 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -2.3540 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -1.8080 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 -0.7980 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8500 1.2790 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 2.9690 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 2.5810 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -1.9010 -6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -0.5410 -6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.2700 -5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 M END