IBS-ZINC02272463 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 38 0 0 1 0 0 0 0 0999 V2000 -0.1630 0.2550 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -1.0760 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.8730 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -2.1760 -1.5250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7060 -2.7200 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -1.7230 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -1.8750 -3.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -3.0650 -1.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -4.0190 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -4.2700 0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -4.7730 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -5.7150 -0.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 -6.5060 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -6.4670 -1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -7.4440 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 -8.2670 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -8.4090 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -6.6190 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 0.8630 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 0.8240 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 0.0870 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -1.6300 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -1.6630 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.3820 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -0.1750 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.9260 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -4.0750 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -5.3260 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -5.7600 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -8.8730 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -8.9470 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -7.6170 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -7.8840 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -9.1430 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -8.9570 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -5.8770 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -7.2600 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -6.0740 2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -1.2770 -2.8260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 8 9 1 0 0 0 0 8 26 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 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 M CHG 1 39 -1 M END