%chk=000187358.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187358

0 1
O -1.435697 -1.176337 -0.184867
O 1.794637 -0.717194 0.304890
O -1.553148 -2.076025 -2.253073
O 2.150852 -1.520930 2.383781
C -0.648365 2.144846 -0.445573
C -0.327908 -0.304966 -0.601735
C 0.159209 2.253044 0.787410
C -0.904891 0.976112 -1.137985
C 0.484402 -0.195217 0.718716
C -1.119909 3.423032 -0.861209
C 0.148066 3.692483 1.125747
C 0.712640 1.162307 1.327274
C -0.624770 4.398610 0.131066
C -1.669547 1.080228 -2.318802
C -1.878871 3.511325 -2.015859
C -2.144170 2.323910 -2.735036
C 0.730900 4.374612 2.176343
C -0.792051 5.767658 0.216548
C 0.552634 5.772703 2.252470
C -0.191814 6.453039 1.294398
C -1.971749 -2.043956 -1.116941
C 2.555113 -1.379221 1.251631
C -3.053251 -2.850561 -0.508099
C 3.832440 -1.836688 0.660195
C -3.625839 -3.876638 -1.278570
C -3.505773 -2.606552 0.797294
C 4.690295 -2.611099 1.459349
C 4.190260 -1.512361 -0.657037
C -4.649159 -4.656917 -0.737725
C -4.530825 -3.391638 1.330681
C 5.903982 -3.059681 0.935567
C 5.406878 -1.964926 -1.173344
C -5.100599 -4.414633 0.565035
C 6.261333 -2.737060 -0.378894
H 0.272402 -0.837078 -1.385581
H 0.048789 -0.890530 1.487056
H 1.337982 1.170337 2.218659
H -1.882776 0.180198 -2.901775
H -2.263060 4.464068 -2.371024
H -2.738319 2.387991 -3.647145
H 1.315304 3.853968 2.931947
H -1.371332 6.312096 -0.525213
H 1.008185 6.319477 3.077035
H -0.318324 7.532480 1.370076
H -3.265026 -4.054442 -2.295266
H -3.053305 -1.804009 1.386453
H 4.399559 -2.855137 2.484779
H 3.514688 -0.908032 -1.268812
H -5.095803 -5.454111 -1.330467
H -4.885118 -3.206018 2.343905
H 6.572231 -3.660804 1.550740
H 5.688594 -1.715913 -2.195690
H -5.900002 -5.026040 0.984594
H 7.209928 -3.089208 -0.785118


%chk=000187358-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187358

0 1
O -1.630041 -1.334198 -0.042209
O 1.971268 -0.840672 0.154986
O -1.882517 -2.490147 -2.056246
O 2.591072 -1.617594 2.265605
C -0.475268 1.729357 -0.502684
C -0.335842 -0.750996 -0.567579
C 0.051795 1.788894 0.868511
C -0.640361 0.564027 -1.258428
C 0.561557 -0.643159 0.688825
C -0.806927 3.028549 -0.970807
C -0.019518 3.216833 1.262109
C 0.527507 0.657404 1.467154
C -0.527477 3.970276 0.142537
C -1.131486 0.704400 -2.581130
C -1.304920 3.166630 -2.282545
C -1.452796 1.995396 -3.075797
C 0.329039 3.865222 2.461374
C -0.681496 5.366279 0.238867
C 0.168838 5.270304 2.551336
C -0.330923 6.011447 1.451447
C -2.314433 -2.193893 -0.913307
C 2.899393 -1.342226 1.078185
C -3.583193 -2.698676 -0.316196
C 4.254387 -1.505018 0.478833
C -4.346775 -3.630336 -1.067338
C -4.038443 -2.271120 0.958536
C 5.279052 -2.056848 1.291741
C 4.537225 -1.123921 -0.858983
C -5.555672 -4.133395 -0.545869
C -5.250045 -2.776644 1.474652
C 6.576742 -2.228540 0.769079
C 5.838245 -1.296767 -1.376230
C -6.009251 -3.707421 0.725845
C 6.858599 -1.849088 -0.565491
H 0.095533 -1.489404 -1.266630
H 0.351791 -1.497933 1.356984
H 0.960973 0.638436 2.471811
H -1.278332 -0.181505 -3.207697
H -1.575522 4.144467 -2.695432
H -1.833255 2.090205 -4.098970
H 0.716336 3.299277 3.315688
H -1.064540 5.951256 -0.604269
H 0.433105 5.790176 3.478610
H -0.446215 7.097425 1.540848
H -3.976041 -3.942427 -2.049278
H -3.444064 -1.549072 1.524915
H 5.036863 -2.341495 2.321003
H 3.740694 -0.696052 -1.473801
H -6.143571 -4.853111 -1.125434
H -5.603631 -2.446526 2.457321
H 7.366450 -2.655452 1.396518
H 6.057880 -1.001728 -2.407890
H -6.949786 -4.097852 1.130624
H 7.867899 -1.982440 -0.970903


