IFLAB-ZINC02456320 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.5110 -0.3430 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.6700 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -2.1310 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.2730 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 0.0570 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 0.5180 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -1.8500 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -1.0000 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 -1.7440 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 -2.9320 -1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 -0.9910 -0.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2600 -1.6200 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1100 -0.8470 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1520 0.5860 -1.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 1.2170 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 0.4400 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3770 1.2430 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4710 0.6970 -1.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3770 2.7180 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3930 3.4030 -2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 4.7940 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5290 5.5030 -1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5250 4.8220 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4420 3.4160 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4130 2.7410 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7260 1.6810 1.0860 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5020 0.0190 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -2.3440 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -3.1660 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 0.7600 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 1.5530 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -0.1880 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 -0.6140 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7540 -1.6190 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1570 -2.6630 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -1.2710 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6710 -0.9430 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 2.2580 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 1.2090 -2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 0.8930 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 0.4970 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3640 2.8480 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4800 5.3240 -3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5930 6.5880 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5900 5.3920 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0440 3.3190 1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 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 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 2 0 0 0 0 M CHG 1 26 -1 M END