%nprocshared=24
%mem=41GB
#p m062x 6-311+G(d,p) scrf=(pcm,solvent=generic,read) nosymm integral(grid=superfine) scf=maxcyc=512

Single point

0 1
 C                 -3.58459200    4.09253500    1.90647900
 C                 -2.85313400    4.33734500    0.67516200
 C                 -3.54963500    4.65896500   -0.49536800
 C                 -5.00003400    4.73123500   -0.48248300
 C                 -5.69909600    4.49174000    0.70207500
 C                 -4.97645300    4.17225800    1.92284200
 C                 -2.90543600    3.03689700    2.63713300
 C                 -1.75392900    2.62287800    1.87070600
 C                 -1.72019100    3.43760600    0.63276700
 C                 -1.31465700    2.88973200   -0.56695000
 C                 -3.14290700    4.06505400   -1.74626500
 C                 -5.48896100    4.18138100   -1.73694000
 C                 -6.65572000    3.41297200   -1.75314100
 C                 -7.38526300    3.17098100   -0.52128900
 C                 -6.91326300    3.69773600    0.68316400
 C                 -6.94929000    2.89578200    1.89647100
 C                 -5.75342800    3.18845400    2.66266800
 C                 -5.10414900    2.17185000    3.36492700
 C                 -3.65544500    2.09697300    3.35806100
 C                 -1.40070900    1.28984300    1.83639700
 C                 -2.18737600    0.31918500    2.53368400
 C                 -3.28694400    0.70309600    3.30620800
 C                 -4.50109800   -0.10138500    3.30639000
 C                 -5.62450100    0.81051800    3.32463300
 C                 -6.78092500    0.52995400    2.58867000
 C                 -7.44664300    1.59063800    1.85578900
 C                 -7.92930100    1.03979500    0.59948900
 C                 -7.89956200    1.81241400   -0.56275500
 C                 -4.33883600    3.76625300   -2.51927000
 C                 -5.96599200   -0.54082000   -2.64540800
 C                 -5.22837000    0.40773100   -3.35680700
 C                 -3.77744600    0.34436800   -3.35505700
 C                 -3.11422400   -0.65498800   -2.63295500
 C                 -3.88714500   -1.63508600   -1.89013700
 C                 -6.02077800   -1.84343000   -0.68892500
 C                 -7.15323400   -0.93633100   -0.65562300
 C                 -7.11934100   -0.13068600   -1.86766400
 C                 -7.48782000    1.21552600   -1.82202100
 C                 -6.72094000    2.20481900   -2.55889300
 C                 -5.61309600    1.80826900   -3.31190300
 C                 -3.26859700    1.69341000   -3.31790900
 C                 -2.12669200    1.96824700   -2.56083800
 C                 -1.42772200    0.92211500   -1.85939500
 C                 -1.91215300   -0.36247900   -1.89122100
 C                 -3.17110100   -1.97026800   -0.68702900
 C                 -3.87760500   -2.20883800    0.49213500
 C                 -5.32936200   -2.13914200    0.48899100
 C                 -7.55084600   -0.36190600    0.55273100
 C                 -6.83629100   -0.67487400    1.77994500
 C                 -5.74741500   -1.54968100    1.74741600
 C                 -4.54687800   -1.25648200    2.51791900
 C                 -3.39507400   -1.70305200    1.75861500
 C                 -2.24678500   -0.88347700    1.70618400
 C                 -1.45223100   -0.69827300    0.54623400
 C                 -0.71671300    0.63683300    0.64989600
 C                 -0.67386800    1.51087100   -0.67786200
 C                 -4.39905700    2.60683400   -3.29199100
 C                 -2.06066600    3.17797500   -1.76142400
 C                 -5.28646600   -1.59857600   -1.91450500
 C                 -1.83346500   -1.29843600   -0.70233700
 C                 -0.67062700   -2.72460300   -1.26488200
 C                  3.93518000    1.94808600    3.33077400
 C                  5.38585500    1.89323700    3.33979700
 C                  6.12406900    2.80729000    2.58568000
 C                  5.43989400    3.81543300    1.79138700
 C                  4.04637300    3.85687700    1.77166600
 C                  3.27475700    2.90531200    2.55184500
 C                  3.43602900    0.59413900    3.35831300
 C                  4.57495000   -0.31262600    3.38599400
 C                  5.78269700    0.49441400    3.37399400
 C                  6.89911400    0.06797900    2.65180000
 C                  7.28523400    2.36451400    1.83918100
 C                  6.18845300    4.00396300    0.55857100
 C                  5.51240100    4.24125400   -0.63958700
 C                  4.06194400    4.29980200   -0.65566500
 C                  3.33995100    4.10246400    0.52718300
 C                  2.13001400    3.30960600    0.52625600
 C                  2.08769700    2.55502200    1.80178600
 C                  1.59499000    1.26686700    1.84738400
 C                  2.29906800    0.26929200    2.61022000
 C                  4.53108100   -1.51450200    2.68003600
 C                  3.34480800   -1.86270100    1.91305500
 C                  2.25645800   -0.98199900    1.87184600
 C                  1.52624700   -0.75706500    0.65165300
 C                  0.86858600    0.61114900    0.68212500
 C                  0.90906000    1.43177500   -0.68740600
 C                  1.67989600    2.74029600   -0.64581800
 C                  2.44235600    2.90105900   -1.85358100
 C                  3.60246800    3.68198200   -1.87642300
 C                  7.32546600    3.10457700    0.58596300
 C                  5.85473400    1.13096100   -3.31052900
 C                  6.99242100    1.46212300   -2.57219600
 C                  7.66644400    0.44774000   -1.78105800
 C                  7.17554500   -0.85920400   -1.75733100
 C                  5.99170500   -1.20286000   -2.52039100
 C                  3.89118700   -0.16096700   -3.29382600
 C                  3.50777000    1.22993200   -3.32674700
 C                  4.71860300    2.03618100   -3.33757600
 C                  4.76487500    3.23510300   -2.62774200
 C                  5.94862500    3.58209000   -1.86056300
 C                  7.04096500    2.71349600   -1.83280300
 C                  8.13171000    1.07023100   -0.55325600
 C                  8.09362200    0.36144800    0.64797200
 C                  7.58866600   -1.00088200    0.67395400
 C                  7.13587400   -1.59895700   -0.50372100
 C                  5.92752500   -2.40045200   -0.49166900
 C                  5.21499400   -2.15066200   -1.73597000
 C                  3.82191300   -2.07298500   -1.73575900
 C                  3.14111400   -1.06072800   -2.52735800
 C                  2.39253200    1.65114500   -2.59315000
 C                  1.59617000    0.71631600   -1.84461500
 C                  1.98021900   -0.60802400   -1.79099400
 C                  1.94659200   -1.35914700   -0.51350800
 C                  3.08306500   -2.25399800   -0.49768200
 C                  3.76888400   -2.51398500    0.69509000
 C                  5.21862800   -2.58044300    0.69891600
 C                  5.69180200   -1.95974400    1.92715400
 C                  6.85157800   -1.18325200    1.91225600
 C                  7.74418500    2.47065300   -0.58559300
 C                  7.66586200    1.02164500    1.86983700
 C                  5.34215900   -0.22983300   -3.28326100
 N                 -0.33108100   -3.84277000   -1.13488500
 K                  1.89587200   -5.54082500   -1.65649900
 N                  1.85027300   -5.87548300    1.19977800
 C                 -0.11763500   -7.45136000   -2.46305500
 K                 -0.08352200   -3.94949300    2.00632800
 C                  1.46475700   -6.98065400    1.34932900
 N                 -1.18137700   -7.74082100   -2.04222100
 C                 -2.33721800   -5.72706200    1.85763800
 K                 -0.90262600   -8.55639200    0.72226800
 K                 -2.84920300   -5.50926700   -1.44981700
 N                 -2.90572400   -6.52711400    1.20333000

solventname=c60
eps=4.08
epsinf=3.83


