%nprocshared=24
%mem=41GB
#p opt=(loose,modredundant,calcfc,ts,noeigentest,maxstep=8) b3lyp genecp scrf=(solvent=generic,read,pcm) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024,conver=6) int(grid=fine)

Loose ts

0 1
 C                 -3.78080600    4.10943200    1.83259200
 C                 -3.04783400    4.35512100    0.60215400
 C                 -3.74640400    4.60285800   -0.58508100
 C                 -5.19913900    4.59777800   -0.59018200
 C                 -5.89912600    4.35769800    0.59384900
 C                 -5.17533300    4.11518200    1.83164500
 C                 -3.05518500    3.11591800    2.60424100
 C                 -1.87232000    2.74125900    1.86462900
 C                 -1.86614200    3.51776600    0.60083500
 C                 -1.41264600    2.95843500   -0.57747200
 C                 -3.29307700    3.99304000   -1.81225700
 C                 -5.64278200    3.98341400   -1.83150800
 C                 -6.76714200    3.15343900   -1.83577300
 C                 -7.49813000    2.91123200   -0.60470300
 C                 -7.06936100    3.50000800    0.58734300
 C                 -7.07733400    2.73505400    1.82506000
 C                 -5.90826700    3.11506400    2.59417800
 C                 -5.21446000    2.15714700    3.33565600
 C                 -3.76375100    2.16046200    3.34736700
 C                 -1.44704700    1.42829100    1.87873900
 C                 -2.19383000    0.43925300    2.59666500
 C                 -3.32110300    0.78701300    3.34513800
 C                 -4.49119700   -0.08196100    3.35668500
 C                 -5.66129900    0.76918100    3.33333300
 C                 -6.79255800    0.40416000    2.59450000
 C                 -7.50411100    1.40452800    1.82076700
 C                 -7.94170800    0.78946600    0.57758500
 C                 -7.93875700    1.52591400   -0.60819100
 C                 -4.46251000    3.60604100   -2.58786100
 C                 -5.85662100   -0.78427000   -2.59348000
 C                 -5.16291700    0.17979500   -3.32820000
 C                 -3.71085400    0.19467200   -3.30795800
 C                 -3.00508300   -0.74541800   -2.54675900
 C                 -3.73164600   -1.74402700   -1.78152300
 C                 -5.86638800   -2.02693700   -0.59717200
 C                 -7.04626900   -1.18105800   -0.60529000
 C                 -7.03998600   -0.41259300   -1.84192800
 C                 -7.48080900    0.91311000   -1.84354400
 C                 -6.75858800    1.91873200   -2.60344300
 C                 -5.62253900    1.55882100   -3.33265600
 C                 -3.27557600    1.56986500   -3.30893600
 C                 -2.16024300    1.92994600   -2.54751300
 C                 -1.42228300    0.94485800   -1.80260400
 C                 -1.83224600   -0.36519700   -1.80067900
 C                 -3.00915800   -2.00855000   -0.56218600
 C                 -3.72052100   -2.24236100    0.61767300
 C                 -5.17458600   -2.24834000    0.59634100
 C                 -7.48955300   -0.59114100    0.57982800
 C                 -6.77433500   -0.82660100    1.82388600
 C                 -5.64028100   -1.64294200    1.83072100
 C                 -4.46721000   -1.26238300    2.60483800
 C                 -3.28450400   -1.67187900    1.87279000
 C                 -2.18298700   -0.79054500    1.80663800
 C                 -1.39360000   -0.59796200    0.64920400
 C                 -0.72796400    0.77313400    0.71615600
 C                 -0.70901200    1.60744500   -0.63636600
 C                 -4.45299600    2.42209400   -3.32524500
 C                 -2.16370500    3.16694200   -1.78781700
 C                 -5.13065100   -1.78150800   -1.82221800
 C                 -1.71125600   -1.26236000   -0.58392200
 C                 -0.42834900   -2.59927300   -1.10297200
 C                  3.97799500    2.07446800    3.30917700
 C                  5.42701700    1.98721700    3.29276300
 C                  6.16732500    2.87152300    2.50766000
 C                  5.48915500    3.88058400    1.70790100
 C                  4.09787500    3.95451600    1.71315600
 C                  3.32259400    3.03342300    2.52564400
 C                  3.45355000    0.73101800    3.36927100
 C                  4.57363500   -0.20006700    3.39158000
 C                  5.79690200    0.58044000    3.34290700
 C                  6.89131600    0.11643900    2.60833500
 C                  7.29960400    2.38639100    1.74489700
 C                  6.21331300    4.02606600    0.45605300
 C                  5.52591600    4.26360500   -0.73428500
 C                  4.07797200    4.35613100   -0.72470400
 C                  3.37460500    4.19407000    0.47588500
 C                  2.14841000    3.42747800    0.51087700
 C                  2.11506800    2.69717400    1.80268300
 C                  1.59954000    1.41995900    1.88036600
 C                  2.29717700    0.41876200    2.64682300
 C                  4.49269900   -1.41329000    2.70666500
 C                  3.28613600   -1.74926800    1.96813800
 C                  2.21842200   -0.84294700    1.92973600
 C                  1.47659900   -0.62037700    0.71881800
 C                  0.84892200    0.76237600    0.73672800
 C                  0.87523800    1.55349400   -0.64842900
 C                  1.66170900    2.85205600   -0.64498900
 C                  2.40928500    2.97393900   -1.86938000
 C                  3.58473200    3.72850700   -1.92757400
 C                  7.31609500    3.09100400    0.47516200
 C                  5.76074300    1.10256000   -3.35883400
 C                  6.91807100    1.42081900   -2.64656300
 C                  7.58600500    0.40507500   -1.84950400
 C                  7.06994500   -0.89103200   -1.79348000
 C                  5.86536300   -1.22153200   -2.52969800
 C                  3.77271600   -0.14590200   -3.28324400
 C                  3.41698300    1.25236800   -3.33348900
 C                  4.64309300    2.03213400   -3.38046500
 C                  4.72458000    3.24234300   -2.69189700
 C                  5.92808300    3.57531000   -1.95153300
 C                  7.00183800    2.68247700   -1.92918800
 C                  8.08287300    1.03682800   -0.63967700
 C                  8.05344000    0.35077800    0.57550000
 C                  7.52301300   -0.99988100    0.63502200
 C                  7.03764300   -1.60768400   -0.52508700
 C                  5.81374400   -2.38315900   -0.47706000
 C                  5.08493000   -2.13933500   -1.71345700
 C                  3.69467100   -2.02830500   -1.68775400
 C                  3.02112800   -1.01559300   -2.48491000
 C                  2.32568400    1.71148200   -2.58526500
 C                  1.53328600    0.80685600   -1.80137400
 C                  1.88989100   -0.52260900   -1.73267500
 C                  1.86245100   -1.24962900   -0.44325200
 C                  2.97746400   -2.16960600   -0.43285400
 C                  3.67582600   -2.42793300    0.75184200
 C                  5.12298900   -2.52681500    0.73025000
 C                  5.63022300   -1.89656700    1.94010300
 C                  6.80530100   -1.14556200    1.89060100
 C                  7.71722000    2.44139400   -0.69012500
 C                  7.66021300    1.03941300    1.79390100
 C                  5.22175400   -0.24701400   -3.29774200
 N                 -0.16047000   -3.74433300   -1.11091500
 K                  2.05745500   -5.53613900   -1.50763200
 N                  1.88168300   -5.88190800    1.35124100
 C                  0.13958700   -7.48205200   -2.56786100
 K                 -0.06270300   -3.92536300    2.14403500
 C                  1.53482800   -6.99888700    1.50524300
 N                 -0.88291200   -7.72528200   -2.03175000
 C                 -2.35792000   -5.68964200    1.90704500
 K                 -0.84271700   -8.55589000    0.73985200
 K                 -2.61507200   -5.47497900   -1.53843200
 N                 -2.80673500   -6.46162900    1.13662900

61 90 F

C N 0
6-31G(d)
****
K 0
LanL2DZ
****

K 0
LanL2DZ

solventname=c60
eps=4.08
epsinf=3.83


