IBS-ZINC05488015 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.9010 -0.1240 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.3900 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1330 -1.1590 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -0.8590 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -0.5530 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.9830 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -1.7190 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -2.0260 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -1.6000 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 0.8430 -0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.0510 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9210 2.8960 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 1.8430 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 3.0790 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 3.3040 2.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 3.5520 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 2.3360 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 4.7800 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 3.8050 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 0.8670 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.1110 -2.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 2.0810 -2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 2.8550 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 3.9870 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 4.3580 -4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 3.5980 -4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 2.4580 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 1.5000 -4.4940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 0.0810 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 0.7350 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -1.0000 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 0.0220 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.7430 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -2.0550 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -2.6010 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -1.8430 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.9670 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 1.6960 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 2.9190 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 3.9480 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 2.5400 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 1.4700 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 4.5990 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 4.9680 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 5.6460 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 4.6710 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 3.9940 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 2.9300 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 2.5670 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 4.5860 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 5.2460 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 3.8930 -5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 M END