IBS-ZINC04863060 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6940 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1100 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7740 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.9860 -0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9990 -1.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6600 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0110 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.6320 -2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.8210 2.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.1990 3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.9180 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.2500 5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.8440 5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.0860 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.7330 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0440 2.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.2140 7.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.6320 8.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.0030 9.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.1430 9.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.4730 10.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.7150 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -2.3380 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -2.3130 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -3.9970 4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.8100 6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.9920 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -1.4760 7.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 2.0620 9.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 1.1810 10.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.0370 8.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -1.2250 10.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 0.3670 10.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -0.9100 9.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 18 2 0 0 0 0 4 5 1 0 0 0 0 4 11 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 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 31 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END