IBS-ZINC02419626 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0400 1.4140 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.0300 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -0.6580 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.0360 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 1.4310 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 2.1160 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 2.1820 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 3.5270 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 3.7440 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 2.5500 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 1.6670 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 5.0890 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 5.5400 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 6.8840 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 7.4280 0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 7.4820 2.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 8.6830 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 9.6180 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 10.8020 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 11.0580 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 10.1290 3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6130 8.9450 3.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 10.4070 4.6740 N 0 3 0 0 0 0 0 0 0 0 0 0 10.9280 11.4520 4.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4860 9.5890 5.5580 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5380 -0.6360 -0.0300 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.9450 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.5150 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.7380 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 3.1960 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 5.0120 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 5.8160 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 5.6170 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 4.8120 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7050 7.0800 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 9.4190 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 11.5300 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 11.9850 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7710 8.2220 4.3900 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 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END