IBS-ZINC02195657 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1860 1.2550 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -0.1200 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -0.8180 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -0.1470 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 1.2540 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.9450 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 1.9890 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 1.3880 -0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 3.2420 0.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 4.1210 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 5.3440 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1410 6.2590 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 5.9580 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 4.7410 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8220 3.8320 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2950 4.4140 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5600 3.3250 -0.0690 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4080 -0.8150 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -2.1340 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -2.9710 0.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -2.5370 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -3.4750 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -3.8800 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 -3.3610 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 -2.4470 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -2.0270 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 -1.9710 -0.9730 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 1.7870 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -0.6580 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -1.8920 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 3.0110 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 3.5790 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 5.6000 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 7.2050 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 6.6730 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 2.8960 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 -0.2040 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -3.8880 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 -4.5980 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 -3.6610 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -1.3270 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 5.2600 0.9350 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 42 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 41 1 0 0 0 0 M CHG 1 17 -1 M END