PUBCHEM-ZINC02853280 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 1.5370 -1.7450 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.9550 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.0160 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 0.7850 3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 1.6390 4.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 0.5270 3.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.4500 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -1.2030 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.1670 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -2.3550 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -1.5720 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -0.6240 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 -1.8640 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -1.1430 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 0.5070 0.1420 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -1.9860 -0.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3470 -1.9990 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2860 -2.6930 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6160 -2.7770 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0120 -2.1910 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0840 -1.5200 1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7500 -1.4330 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4970 -0.9210 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5820 -0.4020 3.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4280 -1.4460 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -2.8140 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -1.5940 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 0.2100 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -2.7950 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -3.1190 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 -0.0360 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -2.7510 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -2.6670 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0010 -3.1600 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3450 -3.3040 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0500 -2.2680 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 -0.9500 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7300 -0.9870 3.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 2 0 0 0 0 M CHG 1 24 -1 M END