IBS-ZINC02140160 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 1 0 0 0 0 0999 V2000 0.0080 1.4980 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0320 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5240 -0.4100 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.5420 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -1.1840 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.4970 3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.1440 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -2.2680 5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -1.7790 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -1.1350 3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.9950 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -0.4270 1.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -0.0070 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -1.5120 2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.6060 1.2980 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3410 0.3840 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.5400 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -1.0220 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -1.0530 -2.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -1.4690 -0.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -1.2730 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -1.5680 1.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -2.0550 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -2.0890 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -2.6670 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 -3.2100 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3870 -3.1770 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -2.6060 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -3.9340 -3.9360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 1.8650 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8540 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.8660 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.5280 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -2.7620 6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -1.9040 5.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 -0.7590 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -2.5550 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -1.3480 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -1.6650 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 -2.6940 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 -3.6010 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5600 -2.5840 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 M END