%chk=000271856.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271856

0 1
O 0.632571 -0.346678 -2.763380
O 1.090588 -2.552051 -2.530424
O 10.712621 1.940720 2.631643
O 9.473006 0.338520 3.577535
O -0.031915 -0.254110 -0.202484
C 5.587578 -0.195948 -0.045511
C 4.960225 -0.269442 -1.444195
C 7.011155 0.374253 -0.101552
C 3.535335 -0.830759 -1.378661
C 7.633535 0.443119 1.297810
C 2.905733 -0.907492 -2.777991
C 9.050109 1.025925 1.245710
C 1.502614 -1.426501 -2.661560
C 9.693872 1.007846 2.597711
C -0.756601 -0.585003 -2.459000
C -2.384646 -0.255537 -0.510651
C -0.966421 -0.361557 -0.961929
C -5.014207 -0.005814 0.437062
C -6.402711 0.126804 0.932529
C -3.445206 -0.843881 -1.214904
C -2.645495 0.446861 0.677502
C -4.752849 -0.718962 -0.745348
C -3.952380 0.575929 1.147763
C -7.390036 0.699773 0.115617
C -6.735069 -0.320383 2.220971
C -8.698949 0.825539 0.588078
C -8.047111 -0.196164 2.685015
C -9.029522 0.377303 1.871122
H 4.955962 0.427366 0.618128
H 5.601591 -1.203432 0.415257
H 4.949025 0.737759 -1.904839
H 5.586234 -0.899628 -2.105408
H 7.639772 -0.250091 -0.766081
H 6.994229 1.382546 -0.559486
H 3.540124 -1.837726 -0.913231
H 2.901775 -0.197717 -0.720058
H 7.660626 -0.566925 1.758529
H 6.998776 1.055471 1.969752
H 2.912008 0.095345 -3.258404
H 3.492017 -1.580874 -3.437852
H 9.039859 2.062713 0.841650
H 9.688068 0.448806 0.538958
H -1.281244 0.168764 -3.074942
H -1.047507 -1.610510 -2.764706
H -3.259547 -1.413419 -2.125536
H -1.811571 0.887175 1.232520
H -5.574929 -1.183624 -1.289386
H -4.150629 1.129479 2.065518
H 11.185907 1.962604 3.504370
H -7.133438 1.052161 -0.882298
H -5.971556 -0.770166 2.854591
H -9.463106 1.273896 -0.045234
H -8.304299 -0.547159 3.683490
H -10.050569 0.474673 2.236019


%chk=000271856-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271856

0 1
O 0.687597 -0.309028 -2.949592
O 0.935165 -2.571127 -2.424098
O 11.071164 1.594860 2.552232
O 9.085416 1.392964 3.736765
O 0.023542 -0.110180 -0.324807
C 5.556160 -0.087266 -0.032810
C 4.991006 -0.448334 -1.425086
C 7.062138 0.257390 -0.058527
C 3.486662 -0.792024 -1.382232
C 7.617337 0.619511 1.336405
C 2.931209 -1.154497 -2.791627
C 9.120189 0.954563 1.292933
C 1.456113 -1.469829 -2.703636
C 9.693731 1.321809 2.647041
C -0.735468 -0.418477 -2.621740
C -2.371802 -0.139474 -0.620247
C -0.961077 -0.209983 -1.108745
C -5.038373 0.011719 0.421708
C -6.423941 0.087003 0.962900
C -3.495769 -0.289282 -1.478210
C -2.600117 0.085387 0.765197
C -4.803126 -0.215427 -0.963838
C -3.905898 0.160994 1.274398
C -7.489541 0.608586 0.177052
C -6.718071 -0.362000 2.280769
C -8.801709 0.679020 0.690030
C -8.030350 -0.294046 2.793765
C -9.079453 0.227289 2.001224
H 4.989278 0.772061 0.380825
H 5.385724 -0.934810 0.662752
H 5.156465 0.401294 -2.120302
H 5.557259 -1.308720 -1.839748
H 7.627132 -0.604951 -0.471213
H 7.231363 1.104015 -0.756920
H 3.315189 -1.645010 -0.697518
H 2.909651 0.060290 -0.977332
H 7.447539 -0.219682 2.037962
H 7.060120 1.481029 1.751456
H 3.089740 -0.307333 -3.481276
H 3.458727 -2.043318 -3.180959
H 9.319815 1.798127 0.602530
H 9.707720 0.103186 0.896189
H -1.234896 0.368315 -3.210696
H -1.120146 -1.414596 -2.916341
H -3.360331 -0.480597 -2.548309
H -1.729284 0.205294 1.418157
H -5.653839 -0.369630 -1.636270
H -4.056558 0.367606 2.339408
H 11.416615 1.833594 3.455325
H -7.284172 0.991886 -0.828867
H -5.922481 -0.797920 2.895309
H -9.605153 1.093868 0.071386
H -8.236357 -0.655307 3.807333
H -10.098452 0.280984 2.399694


