PUBCHEM-ZINC04556769 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 1 0 0 0 0 0999 V2000 -0.4770 1.5400 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 0.1200 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.0210 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -0.2590 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -0.2040 2.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5240 0.8000 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.6670 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -1.6520 4.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 0.1050 4.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -0.2080 5.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7610 -0.6400 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1290 1.0510 5.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 2.1840 6.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 1.7560 7.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 3.4020 6.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -1.2770 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -1.3620 3.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.8030 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -2.0160 3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -1.9300 6.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 2.2730 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.8080 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 1.6360 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -0.5770 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 0.6600 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -1.0430 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 0.2040 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.2710 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 0.4010 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 0.9160 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 0.7700 6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 1.4400 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 2.4900 5.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.9780 7.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 1.3720 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 2.6020 7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.7490 6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 4.2330 7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 3.1680 7.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -1.0920 2.3350 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0430 -2.0290 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -0.7110 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -1.2490 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 40 1 M END