%chk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/metominostrobin_Z/water/CONF37/opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) opt freq Optimization metominostrobin_Z CONF37 water 0 1 O -0.3313261027 -1.1902418030 -0.6824169615 O 0.0466088991 3.5465807858 -1.3730637310 O 1.4500900993 1.0720891927 -1.7330874981 N 1.5343200842 1.0472119884 0.5229120110 N -0.9480178359 2.7494057022 -0.9129245555 C -1.5356517897 0.7038679174 0.0800397496 C -1.3988318345 -0.6821220645 0.0087105989 C -2.6706609547 1.2182496267 0.7144198784 C -0.5408420585 1.6064774018 -0.5206400829 C -2.3514188031 -1.5328908725 0.5506827845 C -3.6227666698 0.3784597590 1.2607264208 C -3.4636153846 -1.0000721996 1.1783399000 C 0.5965090309 -1.9651229921 -0.0355108780 C 0.9101655555 1.2018972477 -0.6412302930 C 0.7358854856 -1.9922232778 1.3459778358 C 1.4535129122 -2.6926437860 -0.8508854702 C 1.7516746326 -2.7556790199 1.9057462938 C 2.4639780593 -3.4474458856 -0.2750668785 C 2.6188121886 -3.4843977201 1.1048006358 C 2.9021014169 0.5871009949 0.6085000796 C -0.4717485543 4.8034464928 -1.7771453381 H -2.7926913962 2.2897394391 0.7935860037 H -2.2243855044 -2.6051251952 0.4700769623 H -4.4879828141 0.7979697702 1.7556993766 H -4.2071074699 -1.6619590249 1.6016772046 H 0.0793734692 -1.4213890697 1.9895659938 H 1.3329221088 -2.6609549913 -1.9264350266 H 1.8628634307 -2.7722362455 2.9820946033 H 3.1349842153 -4.0081073844 -0.9124429637 H 0.9999263374 1.1104174060 1.3754518416 H 3.4101797576 -4.0716670940 1.5506220272 H 3.1199304189 0.3457215686 1.6440079181 H 3.6036468308 1.3556590040 0.2829821851 H 3.0618898639 -0.3060694093 0.0068316179 H -0.9369766166 5.3334386868 -0.9446167035 H -1.1930200339 4.6991023865 -2.5890050636 H 0.3802622620 5.3786802958 -2.1324986362 --Link1-- %oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/metominostrobin_Z/water/CONF37/opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read output=wfx Wavefunction metominostrobin_Z CONF37 water 0 1 opt-b3lyp-pople.wfx --Link1-- %oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/metominostrobin_Z/water/CONF37/opt-b3lyp-pople.chk #P B3LYP 6-311+G(d,p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read td=(singlets,nstates=10) Electronic spectrum metominostrobin_Z CONF37 water 0 1 --Link1-- %oldchk=/home/apulgar/almacen/pesticidas/gaussian_results/C3/metominostrobin_Z/water/CONF37/opt-b3lyp-pople.chk #P B3LYP 6-311+G(3df,2p) EmpiricalDispersion=gd3 scrf=(smd,Solvent=Water) geom=check guess=read Single Point metominostrobin_Z CONF37 water 0 1