PUBCHEM-ZINC05112922 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 0 0 0 0 0 0999 V2000 0.0750 1.4460 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.0730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.5680 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.3310 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 1.9030 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 4.0130 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 5.5340 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 6.2020 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.8620 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 1.8450 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.4750 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.4930 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.5650 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 1.5820 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 3.6640 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 3.6480 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 5.8650 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 5.8500 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 5.9410 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 5.9550 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -1.8240 0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5320 3.4050 0.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9840 3.7300 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 3.7140 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 7.6760 0.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8860 8.1510 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 8.0070 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 8.0200 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 25 1 M END