%chk=EDA_butene_Ph.chk
%mem=120GB
%nprocshared=24
#p opt freq=noraman b3lyp scrf=(smd,solvent=acetonitrile) pop=full def2svp
empiricaldispersion=gd3bj

Title Card Required

0 1
 C                  2.57866400    1.20879300    0.67424300
 H                  3.32192100    1.27996600    1.48839000
 H                  1.67971400    0.75304300    1.12083400
 C                  3.12441100    0.28114100   -0.42060100
 H                  4.04057700    0.74205300   -0.83817000
 H                  2.40155800    0.21211400   -1.25169900
 C                  3.45931100   -1.09388600    0.07947300
 H                  4.07186400   -1.13095300    0.99101900
 C                  3.07472400   -2.24608300   -0.48400300
 H                  2.47356200   -2.26344600   -1.39975700
 H                  3.36214500   -3.21410200   -0.06159800
 S                 -1.89200800   -0.75404400    0.16470000
 O                 -2.58889100   -1.29815700   -0.98805300
 O                 -2.45131200   -0.76203600    1.50527100
 Cl                 0.05277500   -1.55915200    0.22607400
 C                 -1.43510300    1.04587500   -0.25157100
 F                 -0.64446000    1.06614800   -1.30687600
 F                 -2.56697000    1.67336000   -0.51152300
 F                 -0.83506800    1.58784300    0.78957600
 C                  2.24270298    2.61849244    0.15320779
 C                  3.23220115    3.60118879    0.11230972
 C                  0.94925015    2.91286346   -0.27792284
 C                  2.92805879    4.87813456   -0.35899558
 H                  4.25164710    3.36901649    0.45299692
 C                  0.64509441    4.18986655   -0.75032338
 H                  0.16929388    2.13841312   -0.24592399
 C                  1.63418658    5.17251379   -0.79079660
 H                  3.70778428    5.65293850   -0.39067387
 H                 -0.37472184    4.42155832   -1.09057031
 H                  1.39463195    6.17939378   -1.16241818


