%chk=000106239.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000106239

0 1
P 0.215837 -1.340248 0.720542
O -1.385042 -1.071027 0.750554
O 0.780214 0.112245 1.228927
O 0.591376 -1.259057 -0.899090
O 0.696120 -2.566646 1.366693
C -5.580079 1.169658 -0.362015
C 5.240655 1.154642 -0.731309
C -4.039837 1.281407 -0.407909
C 4.443301 0.791059 0.541031
C -3.357408 0.041411 0.175653
C 2.962293 0.540695 0.240578
C -1.837351 0.168396 0.106514
C 2.205549 0.178074 1.517730
C -6.105231 1.276508 1.074653
C -6.209767 2.256973 -1.243603
C 4.874275 2.554384 -1.239444
C 6.746401 1.066168 -0.447642
H -5.875812 0.171642 -0.772392
H 4.991050 0.412699 -1.530723
H -3.714158 1.428280 -1.456231
H -3.716659 2.188323 0.138106
H 4.886620 -0.112018 1.005083
H 4.551120 1.598623 1.290022
H -3.664342 -0.118965 1.230457
H -3.678039 -0.875739 -0.358449
H 2.853418 -0.255053 -0.524649
H 2.499021 1.438779 -0.218386
H -1.455867 1.027483 0.691202
H -1.461659 0.203772 -0.933555
H 2.238811 0.994079 2.268365
H 2.563255 -0.758678 1.986329
H -7.194610 1.169115 1.108730
H -5.678802 0.497118 1.716116
H -5.857891 2.243042 1.526470
H -5.894864 2.162042 -2.287859
H -7.303513 2.195683 -1.225826
H -5.936416 3.262202 -0.905429
H 5.421602 2.800053 -2.155747
H 3.805013 2.631325 -1.465168
H 5.109849 3.328324 -0.501164
H 7.040183 0.057136 -0.140040
H 7.332267 1.318940 -1.338222
H 7.051208 1.755695 0.346871
H 0.830708 -2.104343 -1.346174


%chk=000106239-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106239

0 1
P 0.220929 -1.381303 0.691287
O -1.454665 -1.064124 0.760824
O 0.858832 0.148019 1.132255
O 0.625235 -1.419211 -1.006851
O 0.683382 -2.665915 1.493669
C -5.791376 1.189316 -0.380843
C 5.522373 1.121217 -0.709009
C -4.241636 1.293074 -0.360956
C 4.620725 0.838345 0.523694
C -3.533092 0.056009 0.242365
C 3.122192 0.651040 0.184646
C -2.014973 0.169105 0.116947
C 2.320341 0.267464 1.432869
C -6.389407 1.093133 1.043323
C -6.396913 2.391683 -1.143688
C 5.147193 2.445470 -1.416809
C 7.011895 1.134292 -0.290249
H -6.059296 0.261487 -0.930824
H 5.374588 0.290235 -1.431841
H -3.886079 1.443879 -1.402054
H -3.951195 2.203465 0.205217
H 4.995353 -0.076719 1.029095
H 4.740045 1.670434 1.250260
H -3.788217 -0.057049 1.311449
H -3.870509 -0.863337 -0.273593
H 3.001348 -0.132650 -0.587699
H 2.699630 1.583703 -0.231548
H -1.617888 1.051598 0.650662
H -1.687928 0.202738 -0.940304
H 2.361188 1.061183 2.198389
H 2.679960 -0.680916 1.878858
H -7.493613 1.050365 1.002708
H -6.039794 0.193421 1.580319
H -6.107799 1.980116 1.643956
H -6.003448 2.454798 -2.175771
H -7.498339 2.313163 -1.203240
H -6.154507 3.342300 -0.630006
H 5.823773 2.638826 -2.269847
H 4.113848 2.429581 -1.807091
H 5.235133 3.299185 -0.716548
H 7.305784 0.180516 0.186819
H 7.670679 1.295054 -1.163797
H 7.207597 1.949490 0.433361
H 0.621451 -2.338278 -1.380805


