PUBCHEM-ZINC06506474 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 1.6010 1.3820 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -0.0780 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.4890 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -1.8490 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.8230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.4090 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -1.0490 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -4.2280 0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -5.0690 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -6.3820 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -6.9710 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -8.1600 0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -6.1000 1.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -6.5060 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -4.7560 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -3.9880 2.9290 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -7.1980 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -8.2340 -2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -8.8810 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -8.4650 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -9.0940 -5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -10.1610 -6.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -10.5820 -4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -9.9630 -3.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -10.4550 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -10.8510 -7.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -11.7890 -7.5340 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6410 -4.4220 -2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 1.7390 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 1.5600 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.9690 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 0.2460 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -2.1340 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -3.1430 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -0.7550 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -6.8550 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -7.6480 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -8.7550 -6.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -11.4160 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -10.6710 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -11.3790 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -9.7030 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -4.8270 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -10.4420 -8.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 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 39 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 44 2 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 27 -1 M END