PUBCHEM-ZINC00570108 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 0.2470 1.5860 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 0.3030 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -0.0160 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.8540 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -1.7900 0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.7180 2.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -1.4470 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.6190 2.7710 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -1.0670 4.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.0400 5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -1.0530 5.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -0.9740 7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -0.8800 8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -0.8410 8.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -0.9080 6.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -0.8290 6.6820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -0.9670 7.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 -0.9830 6.0550 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2250 1.4640 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 2.4190 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 1.8710 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 0.4470 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.1540 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -0.9380 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 0.7920 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 0.0450 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -0.7950 4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -1.0800 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.8200 9.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.7520 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.9390 8.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 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 6 26 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 27 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 31 2 0 0 0 0 M CHG 1 18 -1 M END