%chk=000179467.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179467

0 1
O -0.973027 2.023090 1.589707
O 0.973216 -2.023596 -1.589399
C -2.912523 0.299375 0.243858
C 2.912723 -0.299870 -0.243547
C -3.556625 -0.948782 0.880896
C -3.562697 0.618651 -1.117694
C 3.562911 -0.619066 1.118017
C 3.556805 0.948266 -0.880653
C -5.072501 -0.764289 1.028136
C -5.078572 0.801174 -0.967942
C 5.078787 -0.801581 0.968258
C 5.072682 0.763789 -1.027891
C -5.727844 -0.429811 -0.319471
C 5.728039 0.429382 0.319727
C -1.418274 0.126477 0.103747
C 1.418469 -0.126976 -0.103440
C -0.533649 0.993428 0.780976
C 0.533843 -0.993927 -0.780671
C -0.860362 -0.879911 -0.687181
C 0.860555 0.879413 0.687485
H -3.108088 1.173629 0.930081
H 3.108299 -1.174155 -0.929724
H -3.096099 -1.150035 1.865740
H -3.344999 -1.840774 0.260315
H -3.106449 1.528461 -1.549666
H -3.351413 -0.196028 -1.836911
H 3.351625 0.195647 1.837193
H 3.106676 -1.528859 1.550039
H 3.096271 1.149462 -1.865503
H 3.345168 1.840285 -0.260114
H -5.286805 0.038390 1.759142
H -5.521732 -1.684606 1.446660
H -5.532036 0.986961 -1.959801
H -5.293250 1.701785 -0.361821
H 5.293468 -1.702217 0.362174
H 5.532262 -0.987320 1.960121
H 5.521897 1.684095 -1.446459
H 5.286996 -0.038919 -1.758862
H -5.642429 -1.298286 -1.000846
H -6.810673 -0.255480 -0.179441
H 5.642618 1.297888 1.001062
H 6.810870 0.255058 0.179698
H -1.487784 -1.581623 -1.235719
H 1.487976 1.581129 1.236022
H -1.973935 2.051294 1.614838
H 1.974111 -2.051820 -1.614535


%chk=000179467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179467

0 1
O -1.141281 2.494765 0.620413
O 1.141453 -2.494756 -0.621021
C -2.949627 0.164836 0.346201
C 2.949866 -0.164951 -0.346273
C -3.652373 -1.168303 0.709611
C -3.614056 0.775998 -0.929425
C 3.613897 -0.777171 0.929069
C 3.652898 1.168358 -0.708455
C -5.169823 -0.959969 0.923511
C -5.135365 0.980929 -0.737033
C 5.135214 -0.982221 0.736859
C 5.170385 0.959988 -0.922107
C -5.835837 -0.336864 -0.326219
C 5.836000 0.335781 0.327291
C -1.432768 0.058322 0.185310
C 1.432985 -0.058356 -0.185640
C -0.613018 1.216204 0.314449
C 0.613212 -1.216211 -0.314935
C -0.782110 -1.155514 -0.132676
C 0.782322 1.155487 0.132289
H -3.169659 0.858113 1.196128
H 3.169991 -0.857629 -1.196666
H -3.188315 -1.607180 1.613638
H -3.507872 -1.896127 -0.114684
H -3.124741 1.731692 -1.201910
H -3.433745 0.082294 -1.775162
H 3.433531 -0.084049 1.775272
H 3.124375 -1.732978 1.200778
H 3.189166 1.608008 -1.612276
H 3.508238 1.895553 0.116371
H -5.330282 -0.292021 1.795609
H -5.651095 -1.926157 1.169768
H -5.582307 1.378550 -1.668753
H -5.307748 1.745034 0.050438
H 5.307645 -1.745701 -0.051209
H 5.581869 -1.380686 1.668354
H 5.651857 1.926302 -1.167479
H 5.330967 0.292708 -1.794695
H -5.775266 -1.057751 -1.167716
H -6.911527 -0.155021 -0.137008
H 5.775345 1.056006 1.169349
H 6.911706 0.153914 0.138196
H -1.348117 -2.084289 -0.243167
H 1.348342 2.084250 0.242824
H -2.111250 2.431019 0.803357
H 2.111417 -2.431009 -0.803974


