PUBCHEM-ZINC05681257 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0810 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6840 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7610 -2.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.1130 -3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.7930 -4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -4.1910 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -4.8710 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.1720 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.7870 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -2.0940 -5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -2.0490 -8.3750 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.8310 -8.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.6590 -9.4290 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0130 -5.0360 -8.5980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1390 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1590 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6160 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.7370 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -5.9510 -5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -1.0150 -5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -4.5440 0.0240 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 9 10 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 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END