PUBCHEM-ZINC04329654 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2100 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3970 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 4.3310 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 5.5650 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 5.6350 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 4.3740 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 6.7940 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 7.9970 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 8.0650 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 9.2330 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 10.4810 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 11.6310 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 11.5500 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 10.3170 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 9.1580 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 12.7880 0.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5190 13.8760 0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 12.7200 0.0100 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2230 -2.0340 -0.0200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -0.5160 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9430 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 6.7390 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 10.5460 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 12.5970 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9620 10.2600 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 8.1960 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END