IBS-ZINC04088973 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.2030 0.9510 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.5040 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -0.7460 1.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3560 0.0140 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -0.5280 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.1420 1.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3750 -2.3090 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -2.1430 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -2.8820 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.2550 1.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.8430 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -3.5750 2.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -4.8950 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.8910 4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -5.8810 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -6.8660 5.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -6.8900 4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -5.8870 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -8.0140 5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -8.6410 6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -7.9410 6.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -8.1760 6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 1.6140 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.0750 3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.2750 3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.1210 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.8010 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -1.1810 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -0.7200 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 0.5060 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -3.5850 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -4.1060 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -5.8730 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -5.8850 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -8.3300 5.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -9.5220 6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -1.4260 -1.0700 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 37 -1 M END