CHEMBRIDGE-ZINC01065714 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 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 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.7790 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.1790 3.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -1.1630 2.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.7520 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -0.5720 0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -1.1020 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 -1.0280 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -0.6530 -1.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -1.4090 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -1.3410 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 -1.6980 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7610 -2.1260 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 -2.1960 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 -1.8360 1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9860 -2.4790 1.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0660 -2.9100 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -0.6560 2.7990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8890 -0.5580 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 0.5790 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -1.8530 3.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -2.2230 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.5650 2.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -3.4290 4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -3.8140 4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -4.9400 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -5.6910 5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -5.3100 5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -4.1900 4.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -6.7990 6.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -7.5240 7.0650 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 4.8900 -0.4480 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 -2.1280 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 -1.0080 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 -1.6460 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7750 -2.5300 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -1.8860 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4360 -3.7890 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0990 -3.1610 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 -2.1090 3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.4690 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 0.6670 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 0.4800 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.3780 4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4800 -3.2310 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -5.2380 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -5.8960 6.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -3.8980 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -7.8660 6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -6.8760 7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -8.3850 7.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END