IBS-ZINC04089897 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 38 0 0 1 0 0 0 0 0999 V2000 -0.3470 -2.8720 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -2.1870 1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.9830 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.7300 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 0.2160 2.8170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3700 -0.1450 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 0.4360 3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -0.4460 4.6560 P 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -1.8860 4.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4040 5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 0.1750 6.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -1.2890 7.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7740 -1.8620 6.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -1.4430 8.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -2.3970 9.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -0.3200 5.8620 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4340 1.5540 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 2.2870 1.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -2.8500 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -3.9190 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.3910 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -2.2020 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -3.0150 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -2.5340 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -4.0140 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.3290 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.7270 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 0.1880 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 1.4950 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 0.0360 4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 1.4790 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 0.6120 6.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 0.7510 7.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -0.6520 9.1900 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7040 -1.9530 6.7520 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4630 -2.6830 7.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -2.2810 5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.2380 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 1.7560 2.8050 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 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 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 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 M CHG 1 16 -1 M CHG 1 34 -1 M CHG 1 35 1 M CHG 1 39 -1 M END