%chk=000196375.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196375

0 1
P -3.481346 -1.665110 -1.000044
O -0.616324 2.699766 0.211325
O -1.962788 0.964244 2.890003
O -4.438866 2.024687 2.249347
O -3.402404 -0.105157 -0.443227
O 5.465030 1.256649 -1.531786
O -0.922608 -3.955370 -0.143955
O 2.995824 4.649271 0.318111
O -5.116819 -1.914917 -0.949013
O -2.980655 -2.467068 0.295619
O -2.862476 -1.833606 -2.319057
N 1.181388 0.309617 0.491705
N 2.099026 2.541461 0.364000
N 4.276087 2.944720 -0.595640
C -1.072195 1.428286 0.723426
C 0.126301 0.778508 1.434737
C -2.180160 1.798095 1.742609
C -3.599500 1.563162 1.176886
C 1.176547 -1.058026 0.051377
C 2.198970 1.176994 0.083331
C 2.366963 -1.538775 -0.640057
C 3.329880 0.685442 -0.596200
C 3.406042 -0.692498 -0.936599
C -3.912406 0.082637 0.901722
C 0.101238 -1.871039 0.273004
C 2.398710 -2.948292 -1.001742
C 4.439203 1.559355 -0.965708
C 1.348093 -3.774081 -0.796943
C 0.091819 -3.239640 -0.207382
C 3.143008 3.481884 0.038636
C 1.371116 -5.220334 -1.147467
H -1.454678 0.796556 -0.115396
H 0.559922 1.478326 2.188528
H -0.243634 -0.093831 2.047002
H -2.069238 2.865094 2.061930
H -3.774985 2.177481 0.263758
H 4.311126 -1.044660 -1.449989
H -3.391973 -0.594456 1.614540
H -5.001402 -0.117288 0.921119
H -0.798219 -1.550999 0.801853
H 1.198499 2.952911 0.715419
H 3.321257 -3.315424 -1.458340
H -0.854149 2.802862 -0.734766
H -2.718045 1.077721 3.523200
H -5.374136 2.080436 1.961375
H 5.042000 3.597937 -0.826965
H 1.912338 -5.419584 -2.081076
H 0.347331 -5.618231 -1.272685
H 1.843537 -5.814235 -0.351080
H -5.547768 -2.221613 -1.783541
H -2.241880 -3.269268 0.166799


%chk=000196375-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196375

0 1
P -3.400891 -1.574227 -1.175381
O -0.697889 2.681791 0.180004
O -1.941588 0.661243 2.979068
O -4.359695 1.890972 2.639269
O -3.447276 0.043769 -0.462802
O 5.579154 1.230441 -1.507625
O -0.985042 -3.963258 -0.046896
O 2.808517 4.738393 -0.138144
O -5.093251 -1.930940 -1.364745
O -2.928339 -2.525781 0.072402
O -2.591941 -1.480395 -2.541680
N 1.227436 0.338321 0.439687
N 2.026934 2.548424 0.107824
N 4.201064 2.952002 -0.741671
C -1.069594 1.384636 0.809884
C 0.221222 0.833264 1.428925
C -2.136154 1.646290 1.906680
C -3.598954 1.572106 1.409230
C 1.225494 -1.038807 0.079647
C 2.210807 1.184458 -0.029248
C 2.418676 -1.586878 -0.547854
C 3.388114 0.662290 -0.628510
C 3.491906 -0.728625 -0.849307
C -4.038039 0.194265 0.879192
C 0.115030 -1.849721 0.319273
C 2.435183 -2.994531 -0.853900
C 4.476824 1.583534 -1.006103
C 1.337113 -3.817660 -0.643856
C 0.117002 -3.217511 -0.105358
C 3.006452 3.504043 -0.247717
C 1.317449 -5.281347 -1.004350
H -1.468180 0.706613 0.035941
H 0.701708 1.616429 2.042405
H -0.031729 0.006591 2.107447
H -1.971233 2.670511 2.302449
H -3.776352 2.336773 0.624456
H 4.414472 -1.108309 -1.301520
H -3.695915 -0.618223 1.547334
H -5.143860 0.156586 0.796593
H -0.808942 -1.468304 0.758128
H 1.046256 2.897202 0.245363
H 3.346383 -3.409654 -1.300203
H -1.280826 2.878922 -0.591961
H -2.711850 0.766344 3.598792
H -5.331895 1.823560 2.467071
H 4.934881 3.624207 -0.987416
H 2.281210 -5.608543 -1.428513
H 0.512311 -5.485772 -1.733049
H 1.085531 -5.900586 -0.118594
H -5.400780 -1.793791 -2.297276
H -1.984313 -3.320516 0.039324


