%chk=000225758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225758

0 1
O 2.200464 0.752500 2.450606
O -0.718188 -2.295393 -0.563722
O 4.334934 1.586770 -0.040057
O -6.298528 -1.203160 1.582257
O 5.327746 -0.923166 0.480483
O 4.157160 -1.455879 -1.382292
C -0.085075 1.566485 0.542344
C 1.102842 0.599963 0.234693
C -1.280867 1.247734 -0.364840
C -1.766178 -0.189757 -0.025582
C -2.973299 -0.596631 -0.926126
C 2.240700 1.246755 1.102227
C 0.550842 2.965159 0.482500
C 0.677510 -0.812707 0.644350
C -2.423347 2.258141 -0.179706
C -4.123255 0.454792 -0.798196
C 1.974076 2.768559 1.048162
C -0.615069 -1.201082 -0.056052
C -3.623077 1.887158 -1.056317
C 1.539323 0.598605 -1.232518
C -2.555701 -0.719370 -2.400513
C -4.831861 0.371423 0.562939
C -3.470380 -1.958964 -0.464515
C 3.663644 0.855692 0.641356
C -5.319832 -1.025538 0.888277
C -4.517536 -2.144256 0.342803
C 4.104736 -0.515009 1.126638
C 5.229320 -1.360698 -0.833119
C 6.592842 -1.665857 -1.334424
H -0.411733 1.398222 1.600682
H -0.956385 1.274124 -1.435749
H -2.138313 -0.190427 1.034004
H -0.021242 3.704010 1.065064
H 0.587587 3.347011 -0.553058
H 0.559842 -0.897073 1.743115
H 1.468284 -1.553942 0.387974
H -2.071329 3.274889 -0.440158
H -2.728980 2.309643 0.882621
H -4.881606 0.208692 -1.585891
H 2.728705 3.269292 0.407230
H 2.088170 3.220372 2.047490
H -4.447000 2.607601 -0.887827
H -3.353334 1.993020 -2.126015
H 1.944330 1.566562 -1.550881
H 2.321378 -0.156954 -1.428391
H 0.709834 0.356324 -1.908059
H -2.194028 0.231200 -2.805171
H -1.748912 -1.457773 -2.524271
H -3.389322 -1.050394 -3.029887
H -5.688675 1.075867 0.593138
H -4.161091 0.706404 1.380353
H -2.881437 -2.807523 -0.838764
H 1.464188 1.162383 2.949998
H -4.851520 -3.137626 0.649497
H 3.317844 -1.281158 0.968842
H 4.382791 -0.482537 2.201936
H 7.352128 -1.645484 -0.534852
H 6.899226 -0.923982 -2.092162
H 6.625450 -2.656313 -1.815362


%chk=000225758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225758

0 1
O 2.078351 0.838924 2.399562
O -0.620028 -2.212046 -1.071892
O 4.376887 1.415504 -0.225897
O -6.126680 -1.513646 1.861482
O 5.451097 -0.912994 0.829434
O 4.121550 -1.674412 -0.922968
C -0.039152 1.606537 0.387652
C 1.158321 0.664575 0.038199
C -1.305291 1.313542 -0.439554
C -1.731119 -0.182736 -0.206094
C -3.041885 -0.578288 -0.995361
C 2.268341 1.287863 0.998242
C 0.577659 3.026358 0.340091
C 0.763316 -0.801269 0.338495
C -2.468871 2.265274 -0.074343
C -4.189812 0.435751 -0.634477
C 2.044139 2.825400 0.851450
C -0.540793 -1.156339 -0.387941
C -3.761394 1.910299 -0.840450
C 1.602924 0.772547 -1.444838
C -2.798582 -0.575945 -2.534019
C -4.753615 0.209132 0.792916
C -3.476912 -1.988517 -0.599835
C 3.693927 0.837769 0.653382
C -5.199448 -1.232649 1.042160
C -4.464750 -2.278753 0.299420
C 4.229209 -0.366570 1.441677
C 5.258237 -1.529173 -0.416729
C 6.575592 -1.949848 -1.017488
H -0.318668 1.396050 1.449625
H -1.072564 1.458267 -1.513579
H -1.967890 -0.253276 0.882105
H 0.015951 3.746877 0.959220
H 0.572712 3.413844 -0.695369
H 0.614266 -0.925941 1.431191
H 1.539652 -1.513049 0.007042
H -2.177184 3.308452 -0.302291
H -2.647028 2.221622 1.020508
H -5.017614 0.219441 -1.342229
H 2.782295 3.231516 0.139415
H 2.227489 3.315893 1.824576
H -4.585480 2.576430 -0.517677
H -3.607177 2.106533 -1.919552
H 1.954417 1.782925 -1.711923
H 2.426065 0.066210 -1.645100
H 0.774343 0.504269 -2.123884
H -2.460073 0.408271 -2.901595
H -2.040090 -1.326739 -2.809300
H -3.737416 -0.823654 -3.062772
H -5.615728 0.874896 0.981103
H -3.998438 0.457725 1.566854
H -2.940380 -2.804316 -1.098836
H 1.272727 1.275230 2.772310
H -4.749102 -3.315991 0.513706
H 3.450604 -1.142840 1.530296
H 4.525108 -0.048915 2.454122
H 7.279497 -2.275341 -0.235733
H 7.024204 -1.082119 -1.534862
H 6.413081 -2.751861 -1.752548


