%nprocshared=24
%mem=120GB
#p opt=(calcfc,noeigentest,ts,maxstep=3) freq=NoRaman ub3lyp/genecp scrf=(smd,solvent=thf) nosymm scf=xqc EmpiricalDispersion=GD3 Int=Grid=UltraFine

Co - ZEq <=> Psyn rotOH TS opt

1 4
 Co                 1.05460200   -0.01695800   -0.59265200
 P                 -1.29331500    0.06746500    0.11302300
 P                  1.22557600    0.54157900   -2.94185100
 C                 -1.56521200    1.28362300    1.44784600
 C                 -2.67751400    1.22496600    2.30497800
 C                 -0.61508900    2.30422700    1.61538500
 C                 -2.83257900    2.17770700    3.31198500
 H                 -3.41434000    0.43543800    2.18915100
 C                 -0.77498000    3.25530100    2.62527700
 C                 -1.88216600    3.19157600    3.47391400
 H                 -3.69379200    2.12778200    3.97221100
 H                 -0.03053900    4.03631300    2.75116500
 H                 -2.00367500    3.92716100    4.26415300
 C                  0.26743000    2.04002400   -3.36244700
 C                 -0.00761200    2.38745700   -4.69474000
 C                 -0.20930100    2.84728800   -2.32047500
 C                 -0.75133600    3.53335600   -4.97416500
 H                  0.35237800    1.76198600   -5.50702000
 C                 -0.95532200    3.99223400   -2.60398600
 C                 -1.22599500    4.33501300   -3.93041400
 H                 -0.96539900    3.79888400   -6.00565000
 H                 -1.33161900    4.60541600   -1.79012100
 H                 -1.81121800    5.22305400   -4.15269200
 C                 -2.44022100    0.51503500   -1.24300100
 C                 -3.43340000    1.49436600   -1.10145800
 C                 -2.22918700   -0.04327200   -2.51715000
 C                 -4.18458200    1.91153200   -2.19998000
 H                 -3.60654200    1.94886600   -0.13165500
 C                 -2.96681700    0.37097300   -3.62355900
 C                 -3.94218300    1.35556400   -3.45746800
 H                 -4.94613100    2.67516000   -2.07531200
 H                 -2.77648400   -0.06080700   -4.59960200
 H                 -4.51312300    1.68568200   -4.32040500
 C                 -1.83849600   -1.54620500    0.79267500
 C                 -1.46698800   -1.88628500    2.10499400
 C                 -2.50977600   -2.49104700    0.00290000
 C                 -1.75605500   -3.15189000    2.61496800
 H                 -0.96553800   -1.15911500    2.73699400
 C                 -2.79781000   -3.75656100    0.51914300
 H                 -2.81262600   -2.24826100   -1.00919000
 C                 -2.41886200   -4.09210500    1.82098300
 H                 -1.46346900   -3.40040400    3.63132200
 H                 -3.32274200   -4.47925000   -0.09951300
 H                 -2.64316800   -5.07861600    2.21684400
 C                  0.59247900   -0.73960300   -4.08656300
 C                 -0.63296200   -1.35576600   -3.77960600
 C                  1.25325000   -1.12521100   -5.26154600
 C                 -1.18123100   -2.33823000   -4.59782700
 C                  0.70589900   -2.10239000   -6.09549800
 H                  2.19930400   -0.66229200   -5.52262800
 C                 -0.50744900   -2.70888500   -5.76407400
 H                 -2.12206800   -2.80010600   -4.31604800
 H                  1.23114000   -2.39018100   -7.00121800
 H                 -0.93198000   -3.47247600   -6.40890700
 C                  2.96050800    0.87582200   -3.40293700
 C                  3.40761800    2.18503200   -3.63791700
 C                  3.88914700   -0.17793700   -3.36183600
 C                  4.76685700    2.43158200   -3.84081600
 H                  2.70218800    3.00943400   -3.66516200
 C                  5.24375600    0.07482300   -3.57386400
 H                  3.55700900   -1.19381400   -3.16981300
 C                  5.68547200    1.37948700   -3.81008200
 H                  5.10504300    3.44745500   -4.02564900
 H                  5.95445700   -0.74567500   -3.53958100
 H                  6.74276600    1.57585900   -3.96505200
 C                  2.57905000    0.94789700    1.53390400
 O                  2.35929600    1.14515200    0.25383200
 C                  1.97605300   -1.98230200   -0.37222500
 H                  2.82742400   -1.89949100   -1.03876300
 H                  1.12821000   -2.57736500   -0.71260600
 C                  2.10964300   -1.76032900    0.99279200
 H                  1.23829400   -2.02933500    1.58711600
 C                  3.19733300   -1.15995400    1.71133300
 C                  3.18701700   -1.33976600    3.19206100
 C                  4.37367600   -1.54968900    3.92079100
 C                  1.98518400   -1.26164100    3.92980500
 C                  4.35878600   -1.67839100    5.31200900
 H                  5.32628400   -1.62545600    3.40858000
 C                  1.96974800   -1.39001000    5.31643300
 H                  1.04660800   -1.07333100    3.41731300
 C                  3.16003800   -1.59943500    6.02071300
 H                  5.29476700   -1.84258000    5.83995000
 H                  1.02495000   -1.31817900    5.84957300
 H                  3.15049700   -1.69692500    7.10281800
 C                  4.56879100   -1.09433200    1.04074100
 H                  5.23526800   -0.46357500    1.64321100
 H                  5.01636500   -2.09727500    1.00556600
 O                  4.55884300   -0.62441700   -0.30542700
 H                  3.95891600    0.14121000   -0.35422300
 C                  3.68364700    1.68409300    2.17497600
 C                  3.69322500    1.85050500    3.57171700
 C                  4.73330900    2.23083300    1.41312900
 C                  4.73300900    2.54101500    4.19273400
 H                  2.88601200    1.43365400    4.16579900
 C                  5.76864100    2.92193400    2.03786400
 H                  4.73440600    2.10992200    0.33495400
 C                  5.77371100    3.07700500    3.42887800
 H                  4.72998900    2.66120500    5.27257900
 H                  6.57421200    3.34024400    1.44043300
 H                  6.58418100    3.61473300    3.91347600
 H                  1.71217400    0.77695800    2.17633900
 H                 -0.01729800    2.56969100   -1.28824100
 H                  0.25429100    2.35131200    0.96629000
 O                 -1.26624900   -1.03810100   -2.58069500

-C -P -O -H 0
6-31g(d)
****
-Co 0
LANL2DZ
****

-Co 0
LANL2DZ

