PUBCHEM-ZINC05804307 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0820 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6930 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.0100 -2.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 0.3830 -3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 0.1150 -4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.9860 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 0.8410 -4.3010 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1380 0.3980 -3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.3840 -2.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 0.0980 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 0.8420 -3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 1.1240 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 1.6440 -5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.9160 -6.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 1.8040 -5.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 1.5060 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3250 1.6790 -4.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 1.0440 -3.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 0.7440 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 2.3200 -6.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 3.8240 -6.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 4.4520 -6.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 5.8310 -6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 6.5850 -6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0740 5.9600 -7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 4.5780 -7.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 3.9660 -7.4970 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.6280 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6210 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.2190 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 1.4400 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.9360 -4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 0.3570 -5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.6680 -6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 2.0300 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -0.2900 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 1.4110 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 0.8870 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 1.9150 -7.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 2.0210 -7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 3.8640 -6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3260 6.3210 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 7.6630 -6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 6.5480 -7.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 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 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 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 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 12 1 M END