%chk=000181480.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181480

0 1
P 0.165315 -0.171819 0.168640
O -1.009568 0.981203 -0.283219
O 1.427469 0.420485 -0.815923
O -0.349397 -1.416149 -0.880272
C -3.996446 1.700537 1.690989
C 2.233005 3.886469 0.164612
C 0.519923 -4.931874 -0.408332
C -4.375201 -0.351927 0.429100
C 4.184604 2.451107 0.447865
C 2.420695 -3.791021 -1.425360
C -2.266220 0.791914 0.287864
C 2.093623 1.533573 -0.307228
C 0.433351 -2.568572 -0.849382
C -4.828250 0.634011 1.322151
C 3.580255 3.717923 0.514561
C 1.818447 -4.962608 -0.936122
C -2.693857 1.785215 1.175050
C 1.471296 2.783298 -0.252288
C -0.187548 -3.720807 -0.356017
C -3.079179 -0.280097 -0.098198
C 3.437797 1.339383 0.037734
C 1.726797 -2.574517 -1.384044
C -4.484663 2.756126 2.629391
C 1.600126 5.238951 0.216360
C -0.124525 -6.181775 0.097230
C -5.285850 -1.470100 0.037801
C 5.625413 2.298768 0.814036
C 3.799340 -3.851788 -1.998365
H -5.835204 0.569725 1.724632
H 4.166230 4.574608 0.835217
H 2.364402 -5.901025 -0.973621
H -2.030733 2.603159 1.437533
H 0.427875 2.899320 -0.548357
H -1.196509 -3.668615 0.040418
H -2.715356 -1.023620 -0.808700
H 3.876918 0.349272 -0.031085
H 2.167996 -1.657615 -1.777152
H -5.446850 2.502692 3.092526
H -4.620342 3.713006 2.103335
H -3.769685 2.934077 3.445045
H 2.185989 5.961834 0.797854
H 0.594979 5.202804 0.659479
H 1.487894 5.651733 -0.798192
H 0.579565 -7.019281 0.183157
H -0.573786 -6.033515 1.089305
H -0.931086 -6.504373 -0.578272
H -6.116326 -1.099250 -0.581461
H -5.728045 -1.959559 0.916414
H -4.775220 -2.248774 -0.544811
H 5.946380 1.249641 0.851490
H 5.840269 2.737917 1.798406
H 6.270872 2.808072 0.083015
H 4.213927 -2.857323 -2.212155
H 3.804551 -4.411608 -2.945599
H 4.499541 -4.356012 -1.318256


%chk=000181480-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181480

0 1
P 0.184027 -0.196828 0.264567
O -1.129412 0.882389 -0.243292
O 1.422605 0.565782 -0.752110
O -0.207961 -1.485421 -0.890174
C -4.407632 2.034342 1.055881
C 2.457092 3.775130 0.920670
C 0.365296 -5.136780 -1.216674
C -4.337668 -0.435533 1.218951
C 4.363015 2.784932 -0.311507
C 2.540480 -4.052411 -0.742050
C -2.425301 0.801351 0.333608
C 2.189487 1.668167 -0.287880
C 0.499735 -2.717814 -0.897379
C -5.007596 0.796545 1.410737
C 3.810991 3.804724 0.509036
C 1.766563 -5.210280 -0.995727
C -3.098528 2.028418 0.522479
C 1.636140 2.694387 0.506930
C -0.268413 -3.874446 -1.154336
C -3.031944 -0.429058 0.663943
C 3.539639 1.703567 -0.700473
C 1.895341 -2.789434 -0.701613
C -5.164732 3.340359 1.227960
C 1.874648 4.887226 1.776981
C -0.437038 -6.387995 -1.531526
C -5.003378 -1.752974 1.580531
C 5.807098 2.861861 -0.777572
C 4.042995 -4.145124 -0.533583
H -6.018702 0.795270 1.836718
H 4.448427 4.639643 0.825755
H 2.262468 -6.188402 -1.029193
H -2.593422 2.958873 0.242786
H 0.573435 2.671197 0.774501
H -1.347647 -3.771020 -1.308607
H -2.510563 -1.371974 0.462727
H 3.925204 0.890554 -1.324530
H 2.477485 -1.872865 -0.552153
H -5.854015 3.297578 2.089772
H -5.773820 3.564171 0.330588
H -4.478058 4.191473 1.379328
H 2.649984 5.612131 2.078365
H 1.408146 4.486737 2.696156
H 1.089727 5.442868 1.229422
H 0.007835 -7.282489 -1.061006
H -1.480979 -6.300086 -1.182914
H -0.469407 -6.571774 -2.623109
H -5.157647 -2.381445 0.682985
H -5.988452 -1.591011 2.050500
H -4.383253 -2.338353 2.284770
H 6.222273 1.859502 -0.981549
H 6.449112 3.352863 -0.024906
H 5.889102 3.449251 -1.712771
H 4.347043 -3.680865 0.422967
H 4.590305 -3.619522 -1.338972
H 4.384869 -5.194187 -0.525210


