%nprocshared=8
%mem=24000MB
#p wb97xd/genecp opt(ts,calcfc,noeigentest) freq=noraman scrf=(solvent=toluene,smd) nosymm scf(conver=7,xqc,maxcycle=100)

Title Card Required

0 1
 Ru                -2.10958500    0.49237400   -0.11196800
 P                 -1.88146600    2.86763200    0.01197900
 C                 -3.14169900    3.80564100   -0.92780600
 H                 -2.98863600    4.88136400   -0.79148700
 H                 -3.07520400    3.55174200   -1.98767800
 H                 -4.14100500    3.53495600   -0.57396600
 C                 -2.04384500    3.61831300    1.67817400
 H                 -1.27288000    3.23960900    2.35246000
 H                 -1.96238400    4.70834200    1.61235000
 H                 -3.02068800    3.35875800    2.09794900
 C                 -0.31316800    3.57163800   -0.61845200
 H                 -0.19728900    3.29804400   -1.67101500
 H                 -0.31761500    4.66225400   -0.52064300
 H                  0.53712400    3.16144000   -0.06669300
 C                 -3.76645800    0.62442600    0.75695100
 O                 -4.76170200    0.70247000    1.33958300
 P                 -2.38602200   -1.85194100   -0.44809800
 C                 -4.12258200   -2.39620500   -0.63131600
 H                 -4.67498300   -2.19345000    0.29101300
 H                 -4.58561100   -1.83639400   -1.44867100
 H                 -4.17121600   -3.46826300   -0.84817700
 C                 -1.74523600   -2.94813400    0.87335000
 H                 -1.87794800   -3.99964000    0.59865400
 H                 -0.68060900   -2.75108800    1.03413900
 H                 -2.27810800   -2.75907000    1.81027700
 C                 -1.57770400   -2.51209600   -1.94842100
 H                 -0.49700400   -2.36971700   -1.86864200
 H                 -1.80123000   -3.57739500   -2.06691700
 H                 -1.93694700   -1.95800500   -2.81941200
 C                 -1.10217400    0.21180400    1.78182200
 C                 -0.08827900    0.88552000    2.35478800
 H                 -1.57292000   -0.57649600    2.36600500
 C                  0.42454700    0.73890900    3.73097700
 H                  0.44519600    1.63420600    1.76567700
 C                  1.42683700    1.61713600    4.16866300
 C                 -0.04570600   -0.23136100    4.63015000
 C                  1.94095000    1.53749500    5.46154900
 H                  1.80648700    2.37307300    3.48453400
 C                  0.46801000   -0.31415000    5.92027200
 H                 -0.81414100   -0.93483600    4.32266000
 C                  1.46279900    0.57035800    6.34377700
 H                  2.71500000    2.23104000    5.77781300
 H                  0.09246400   -1.07368900    6.60035700
 H                  1.86331100    0.50122500    7.35107400
 Cl                -3.15109900    0.73591400   -2.39145500
 C                 -0.13981100    0.31386300   -0.89769200
 H                 -0.48225900    0.10916800    0.42079700
 C                  0.95916800    0.27905600   -1.43405800
 C                  2.23590000    0.27660400   -2.08354600
 C                  2.81138600   -0.92347500   -2.53165900
 C                  2.92652800    1.48382000   -2.28182500
 C                  4.05094100   -0.91318100   -3.16455600
 H                  2.28132100   -1.85912200   -2.38024100
 C                  4.16453000    1.48778200   -2.91706700
 H                  2.48303100    2.41298100   -1.93647100
 C                  4.72931700    0.29074000   -3.35945300
 H                  4.48804500   -1.84598700   -3.50860100
 H                  4.68878100    2.42691800   -3.06802600
 H                  5.69553000    0.29614300   -3.85543100

Ru
sdd
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-C -H -O -P -Cl
6-31+g*
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Ru
sdd





