PUBCHEM-ZINC06045093 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.3200 1.3000 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.0840 -0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.7990 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -2.0800 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.1280 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.8680 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -0.5780 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -1.5940 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -2.8570 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -3.1360 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -3.2200 1.7220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0330 -4.1430 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -3.1450 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -4.4260 3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -5.5040 2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -3.1980 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -4.2630 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -4.2750 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -3.2110 4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -2.1450 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -2.1470 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -1.0430 4.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -0.9940 5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -5.3740 2.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 -5.4740 3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 1.3600 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.8770 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.6790 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -0.3470 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 0.4040 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -1.3930 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -3.6380 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -4.1260 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -3.0110 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.2880 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -5.1070 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -3.2140 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -1.3080 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 -0.0670 6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0410 -0.9670 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -1.8290 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -4.6580 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 -6.4130 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -5.5080 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -4.2470 4.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 45 -1 M END