PUBCHEM-ZINC01144692 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -1.2540 1.1950 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.1500 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.8490 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.6230 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -1.9300 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.6920 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0110 -2.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.6540 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.8700 -3.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.0950 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.5900 -6.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.1150 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.4980 -7.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 2.1840 -6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 1.4910 -4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 2.3910 -8.7510 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 3.6790 -8.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.5250 -9.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 2.6330 -9.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 3.7600 -8.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 3.9500 -9.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 3.0120 -10.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 1.8850 -10.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 1.6980 -10.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 3.2500 -10.7800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.9450 0.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3530 -4.5570 1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -4.4210 -0.8680 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5300 1.9770 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 1.3510 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 1.2300 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -0.4310 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.6280 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -2.3510 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.9760 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -1.6700 -6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.4140 -8.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 3.2640 -6.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 2.0270 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 4.4920 -8.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 4.8300 -9.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 1.1520 -11.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 0.8200 -10.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 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 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END