%chk=opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 opt freq Optimization imazosulfuron CONF192 gas 0 1 Cl 1.1648847540 1.6518900273 -2.4967000029 S 1.4653420703 1.4789954914 0.9559332470 O 2.1344710119 1.3383098455 2.2254247968 O 1.0607627667 2.7695967691 0.4547675009 O 0.9315072855 -1.4026079419 1.4935611881 O -3.7129778546 2.2428662594 -0.6181880700 O -5.6593606412 -1.9315880152 -0.0229425481 N 3.4463394405 -0.2188080879 -0.0284775395 N 3.1939810916 -0.0188551398 -2.2475675309 N 0.0328732995 0.6195971536 0.9697003186 N -1.2810110820 -1.2922987700 1.0516523756 N -2.4917179701 0.5143345963 0.2327196219 N -3.4687893038 -1.6130401774 0.5237038401 C 2.4175082611 0.6760427408 -0.2495777068 C 3.8881670039 -0.6033726970 -1.2791538782 C 2.3082816806 0.7429767193 -1.6278383769 C 3.9919991850 -0.7177270242 1.1153515791 C 4.9505523184 -1.5142036984 -1.3811709896 C 5.0185661764 -1.6014965188 1.0200120923 C 5.5105976032 -2.0058200044 -0.2391974076 C -0.0226534226 -0.7266619497 1.1959015263 C -2.4612094339 -0.7610386198 0.5833598978 C -3.6431584349 0.9821575050 -0.2384789830 C -4.6132005793 -1.1305871505 0.0618365691 C -4.7730407844 0.1885531424 -0.3483579264 C -2.5448744977 3.0503273516 -0.5376287427 C -5.5124271968 -3.2840906507 0.3803029209 H 3.5723537247 -0.3850744111 2.0483052447 H 5.2863134185 -1.7979915195 -2.3674949393 H -0.8116888461 1.0824975164 0.6157582584 H 5.4464408590 -1.9928309577 1.9306348905 H 6.3292171363 -2.7096683546 -0.2940073859 H -1.3137117380 -2.2798899303 1.2554357714 H -5.7089931035 0.5657967389 -0.7302569389 H -2.8315013126 4.0203402317 -0.9334768627 H -1.7259016450 2.6478651440 -1.1353670389 H -2.2049694732 3.1732442390 0.4915901679 H -4.7631030869 -3.8049728976 -0.2162643711 H -6.4844327004 -3.7435211496 0.2226956861 H -5.2378587978 -3.3653423663 1.4322731350 --Link1-- %oldchk=opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read output=wfx Wavefunction imazosulfuron CONF192 gas 0 1 opt-b3lyp-pople.wfx --Link1-- %oldchk=opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 geom=check guess=read td=(singlets,nstates=10) Electronic spectrum imazosulfuron CONF192 gas 0 1 --Link1-- %oldchk=opt-b3lyp-pople.chk #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 geom=check guess=read Single Point imazosulfuron CONF192 gas 0 1