CHEMBRIDGE-ZINC04989920 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8200 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -2.3810 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -2.6340 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -3.1350 3.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -3.4220 4.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -3.2060 4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.6660 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -2.4110 3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -3.4750 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -3.2310 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -1.9340 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -0.8750 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -1.1050 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 -1.6800 4.0910 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5920 -2.6100 4.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -0.5390 4.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8550 -3.5320 6.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -2.6940 6.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -4.7600 6.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -5.0100 7.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -6.4470 7.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -3.9940 5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -2.3290 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -4.4880 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -4.0530 4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 0.1340 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -0.2770 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -4.8680 8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -4.3160 7.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -7.1400 7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -6.6340 8.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -6.5880 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -3.1810 6.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -4.6390 6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -4.5740 5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -1.3050 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -3.0170 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -2.4440 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END