CHEMDIV-ZINC04733516 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 1.4070 0.6770 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.6040 -0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -1.1610 0.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8370 -0.2870 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -1.9420 1.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2930 -1.2220 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -2.9280 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -4.1350 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -4.9910 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -4.6170 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -3.4020 -2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -2.5660 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.2690 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -0.8520 -2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -5.4560 -3.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -5.0760 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -6.1290 -0.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -7.3200 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -2.4890 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -3.5860 2.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.6290 3.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -1.9960 5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -3.1380 5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -4.2650 7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -4.0060 7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -1.9010 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -1.7050 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -2.3840 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -3.2440 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -3.4610 0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -2.7890 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 0.5890 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 0.9940 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 1.4310 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -4.4450 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -3.0730 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -5.0050 -4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -5.8600 -4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -4.1420 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -7.4610 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -7.3420 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -8.1630 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.7240 3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -2.2760 5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -1.0980 5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -2.8580 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -4.0790 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -5.2330 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 -3.7500 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -4.3810 8.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2860 7.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.9380 6.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -4.1920 8.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -1.0250 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -2.2430 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 -3.7990 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -3.0000 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -3.4070 6.7850 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1950 -2.5100 7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 58 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 58 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 58 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 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END