IBS-ZINC01888743 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -0.3850 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8350 -0.5580 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 1.9600 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.6090 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -1.4920 1.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.8330 0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -2.9270 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -4.0230 1.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4820 -3.7920 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -5.1570 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -4.7750 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -5.8930 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -6.8920 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -4.4480 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -3.8210 0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.9150 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.9050 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.3940 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -0.3840 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 2.1530 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 2.8420 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -5.3280 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -6.0670 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -4.6050 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -3.8650 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 0.7940 0.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 0.7880 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -5.7780 0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -5.5220 1.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -5.7560 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -6.5200 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 28 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 28 29 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 M END