IBS-ZINC02204512 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.3930 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.0090 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6740 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0240 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4240 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 2.1030 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 2.1790 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 3.3170 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 3.6550 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 2.7460 0.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 1.8780 0.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 1.1200 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 4.8130 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 5.5830 -1.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 5.0150 -0.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 6.0540 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 7.2500 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 8.2740 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 8.1090 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1290 6.9200 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 5.8930 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4540 9.4180 -2.9080 S 0 0 0 0 0 0 0 0 0 0 0 0 11.5960 8.8140 -3.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5370 10.2260 -3.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0140 10.3500 -1.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -0.6460 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.9190 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.5400 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.7540 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 3.1820 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 3.8450 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6790 4.4400 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 7.3780 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 9.2040 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1880 6.7940 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8770 4.9660 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7960 10.1170 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5610 11.1300 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -0.8420 -0.8860 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END