#
#Single Point
#
! wb97x-d3bj def2-tzvppd def2/J tightscf defgrid3
%pal nprocs 4 end
%maxcore 8000
%scf guess moread
moinp "oldSP_ts7.gbw" end

* xyz 1 1
  C           0.14090832460656     -3.86748347078604      0.06947540119649
  C           1.35588168229020     -3.28366848155251     -0.30076936388377
  C           1.49206496217776     -1.91010756606833     -0.36707603359659
  C           0.40955858265938     -1.08045792077638     -0.06236199104038
  C          -0.80443821312134     -1.65659122527721      0.33499640288760
  C          -0.93205641678429     -3.02686345797876      0.40091151875992
  H           2.20037332438916     -3.91962021673447     -0.54056841397389
  H           2.44260737567249     -1.47564203351851     -0.65979096799056
  H          -1.64385787277454     -1.03657515399958      0.62956638771097
  H          -1.86701509512375     -3.45437511806790      0.74003091056546
  C           0.60280690441881      0.36386412111903     -0.15389032041231
  H           1.62945574429127      0.72310991541300     -0.14567169608165
  H           0.15574283234969      0.82820806616710     -1.26635197362320
  H          -1.43167371476022      0.98122662219927     -0.22036198390043
  C          -0.22259090360602      2.77961387635121     -0.04036949512788
  C          -1.30183121976827      3.60393566688532     -0.38081357124280
  C           0.97776069073101      3.34826984871015      0.40593399207726
  C          -1.17650875955494      4.97998694293789     -0.29875120777715
  H          -2.23543160853965      3.16168957656739     -0.71317667520951
  C           1.09579362800270      4.72263743165845      0.48849958410681
  H           1.80775252927101      2.72348447366654      0.71514197111129
  C           0.02225575233423      5.53644502303566      0.13193046682893
  H          -2.01032652272378      5.61799420811522     -0.56493068240807
  H           2.01881397338569      5.16595039010956      0.84191009418320
  H           0.12020147343663      6.61375127412505      0.20243632339480
  C          -0.40771817398750      1.34120849824014     -0.14646641617398
  C           0.03859132591263     -5.33614881868225      0.11646530228213
  C          -1.09539981175657     -6.02645736026609      0.17783547642645
  H           0.98337424535585     -5.87010098657882      0.07072914646908
  H          -1.08270701740741     -7.10946373965908      0.19747382574972
  H          -2.07026411137677     -5.55179614535506      0.19675231869205
*

