PUBCHEM-ZINC05680198 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 4.9570 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 5.6550 -0.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 6.9940 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 7.7710 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 9.1280 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 9.7570 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 9.0310 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 7.6360 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 6.8280 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 5.5120 0.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 7.3930 1.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 8.3570 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 6.5390 2.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1030 5.6140 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 7.2690 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 7.4790 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7970 6.5230 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4150 6.7160 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1650 7.8640 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2970 8.8200 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 8.6300 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 6.2200 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 6.6610 3.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 7.2970 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 9.7260 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 10.8350 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 9.5300 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8990 6.6710 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 8.2350 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9920 5.6260 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 5.9690 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6480 8.0150 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 9.7170 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 9.3780 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 5.4460 4.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 5.2690 5.3960 H 0 0 0 0 0 0 0 0 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 1 49 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 50 51 1 0 0 0 0 M END