PUBCHEM-ZINC04827006 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 1.2280 -1.8330 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -1.4660 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.0500 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.8200 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -1.1500 1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.3810 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.1430 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 -2.6690 4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -3.4350 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -3.6730 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -3.1560 2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -3.9660 5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -5.2800 6.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -6.1470 5.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -5.5120 7.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -4.0890 7.7700 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8140 -3.9800 7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -3.2030 6.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -1.9940 6.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -2.7580 9.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -2.4680 11.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 -1.4150 11.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -0.1000 11.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 0.6750 12.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 -0.0120 13.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 -1.7340 12.9300 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 0.4980 10.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.9170 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -1.3950 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -1.4480 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.3820 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -1.8510 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -1.5480 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -2.4860 5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -4.2680 3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -3.3460 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -5.9920 8.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -6.1100 7.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -1.8450 9.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -3.1170 9.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -2.1090 11.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -3.3800 11.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 1.7530 12.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 0.4230 13.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 0.5960 11.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 1.4820 10.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -0.1500 10.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -3.7840 9.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -3.5020 9.0070 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 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 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 48 49 1 0 0 0 0 M END