IBS-ZINC05556552 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3880 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -0.6910 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0110 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.4270 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 2.1020 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 2.1480 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 1.3800 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -0.0030 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -0.6330 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.6160 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 4.3050 -0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 5.7050 -0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 6.4400 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 7.8330 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 8.5610 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 7.9050 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 6.5070 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 5.7840 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 8.6850 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 9.9000 -0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9090 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.5480 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -1.7710 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 3.1820 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 1.8600 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -0.5850 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 4.1240 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 6.1610 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 8.3390 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 9.6400 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 5.9980 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 4.7050 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 8.0520 -0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 8.6060 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 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 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 34 35 1 0 0 0 0 M END