%nprocshared=24
%mem=41GB
#p b3lyp 6-311+G(d,p) empiricaldispersion=gd3 scrf=(pcm,solvent=generic,read) nosymm scf=maxcyc=512

Single point

0 1
 C                 -0.20167300   -0.87783600    0.01888100
 C                 -0.87011700   -1.49571700   -1.20967400
 C                 -0.43300500   -1.47360600   -2.52733400
 C                 -2.06871000   -2.13750000   -0.84872100
 C                 -1.21829400   -2.10782800   -3.49969300
 H                  0.49175600   -0.96937800   -2.79361700
 C                 -2.84378000   -2.77666400   -1.81599200
 C                 -2.40811500   -2.75462300   -3.14550600
 H                 -0.89887200   -2.09911600   -4.53808500
 H                 -3.76788700   -3.28058000   -1.54566300
 C                 -1.20183700   -1.23205100    1.12425500
 C                 -1.14627500   -0.89803900    2.46890900
 C                 -2.27366500   -1.97602800    0.60094900
 C                 -2.18453000   -1.32407600    3.30805300
 H                 -0.31183600   -0.32147100    2.85868800
 C                 -3.30307000   -2.40817400    1.43692100
 C                 -3.24864200   -2.07537400    2.79513800
 H                 -2.16200100   -1.07317400    4.36487400
 H                 -4.13458300   -2.98707200    1.04378100
 C                  1.18365300   -1.44642100    0.31945800
 C                  2.16308100   -0.65532000    0.93123100
 C                  1.47899000   -2.78860300    0.05234900
 C                  3.41142200   -1.19304000    1.24863100
 H                  1.94990400    0.38438300    1.15238900
 C                  2.72530300   -3.31980300    0.37745400
 H                  0.73089800   -3.42238400   -0.41442100
 C                  3.71826400   -2.53125600    0.97498800
 H                  4.15895700   -0.55795500    1.71912700
 H                  2.93212200   -4.36502200    0.15853800
 O                 -0.02064300    0.54932000   -0.09966300
 C                 -1.19914200    1.32670000   -0.40403100
 H                 -1.47975300    1.15772300   -1.45059300
 H                 -2.02803100    0.99907500    0.23270200
 C                 -0.85788800    2.76862000   -0.14650700
 C                 -1.24512600    3.39283700    1.04357000
 C                 -0.09692300    3.49527000   -1.07195400
 C                 -0.89132500    4.71800700    1.29961900
 H                 -1.82329600    2.83542500    1.77737300
 C                  0.25955600    4.81706000   -0.80949300
 H                  0.23987000    3.00937400   -1.98385000
 C                 -0.13619300    5.45320200    0.37639700
 H                 -1.20295900    5.18733100    2.23014000
 H                  0.85416000    5.36593700   -1.53650100
 C                  0.22047400    6.89779800    0.63765500
 H                  1.17767900    7.16379800    0.17642700
 H                 -0.53931700    7.57245300    0.22104200
 H                  0.28809700    7.10700100    1.71055600
 C                  5.08280300   -3.10011400    1.28486000
 H                  5.75553100   -3.00220100    0.42237100
 H                  5.55357500   -2.57898200    2.12531600
 H                  5.02644700   -4.16568600    1.53237100
 C                  2.94385900    1.57871800   -1.81296200
 H                  3.56668400    1.75363500   -2.69603000
 H                  2.80470800    2.53961100   -1.29315600
 H                  3.47952300    0.89408200   -1.13897000
 O                  1.70991400    1.03416200   -2.25913700
 H                  1.16631000    0.86280200   -1.46262800
 H                 -4.04365500   -2.40289400    3.45951600
 H                 -3.00166500   -3.24538100   -3.91214800

solventname=PMMA
eps=3.9
epsinf=2.222

