%chk=000190639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190639

0 1
P 1.596149 -0.549301 -1.136202
O -0.057227 -0.483605 -1.510181
O 2.066045 0.868985 -1.810653
O 2.314717 -1.715415 -1.663879
O -3.099464 1.029906 0.593108
O -0.865240 1.310428 0.617562
N 1.549360 -0.368256 0.581573
C 5.044228 0.643801 1.956213
C 3.711616 0.800711 1.192809
C 2.866201 -0.483280 1.260714
C 5.699852 2.017281 2.155047
C 5.997623 -0.301460 1.215780
C -0.883988 -1.371744 -0.866384
C -1.834127 -0.845172 0.032555
C 1.154313 2.001776 -1.821398
C -0.859570 -2.737361 -1.196601
C -3.299697 2.433472 1.032362
C -2.798698 -1.717907 0.570325
C -1.819643 0.577450 0.423925
C 0.285058 1.940242 -3.063374
C -1.811734 -3.579456 -0.629135
C -2.784778 -3.072151 0.247158
C -4.720986 2.715482 0.578314
C -3.103166 2.479776 2.537251
H 4.828891 0.210821 2.965171
H 3.921382 1.082143 0.141375
H 3.138647 1.648703 1.613379
H 3.437220 -1.348669 0.843378
H 2.663293 -0.745837 2.326290
H 5.914478 2.504561 1.197425
H 5.058652 2.690916 2.732266
H 6.650146 1.927701 2.692585
H 5.552636 -1.292406 1.069616
H 6.933281 -0.438497 1.767310
H 6.256760 0.081722 0.221855
H 0.953300 0.392371 0.979890
H 1.870714 2.847834 -1.855359
H 0.558755 2.049836 -0.887718
H -0.104144 -3.121984 -1.887172
H -2.548867 3.055380 0.495956
H -3.557561 -1.314292 1.246066
H 0.882238 1.678447 -3.948485
H -0.501905 1.174227 -2.976211
H -0.204923 2.899450 -3.259068
H -1.804255 -4.643928 -0.871967
H -3.529221 -3.741843 0.673865
H -4.824934 2.582417 -0.507171
H -5.023610 3.738840 0.826532
H -5.439059 2.029090 1.047110
H -2.056863 2.273174 2.804716
H -3.360822 3.463181 2.946672
H -3.722967 1.734539 3.051305


%chk=000190639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190639

0 1
P 1.587386 -0.807626 -1.335367
O -0.170889 -0.625356 -1.575366
O 2.116195 0.250757 -2.592935
O 2.228729 -2.245945 -1.520193
O -3.211604 0.911450 0.823870
O -0.901738 1.069403 0.654695
N 1.679905 -0.085602 0.205827
C 4.916210 1.007903 2.110809
C 3.758305 1.049335 1.077487
C 2.851558 -0.203222 1.096073
C 5.649787 2.369992 2.145994
C 5.915973 -0.139008 1.821946
C -1.099889 -1.496052 -0.982204
C -2.063831 -0.975957 -0.068400
C 1.800084 1.708402 -2.550996
C -1.147646 -2.850133 -1.386625
C -3.254558 2.273156 1.481932
C -3.108967 -1.832234 0.376304
C -1.964881 0.407841 0.474786
C 0.562567 2.027541 -3.392481
C -2.170053 -3.690519 -0.900951
C -3.162284 -3.179221 -0.029239
C -4.636043 2.834720 1.142065
C -2.997321 2.101316 2.985404
H 4.470369 0.833455 3.114618
H 4.179853 1.175452 0.058812
H 3.128282 1.940187 1.277228
H 3.421115 -1.103078 0.799696
H 2.483142 -0.382409 2.125978
H 6.109514 2.590158 1.163086
H 4.954939 3.196356 2.387260
H 6.456328 2.370414 2.902699
H 5.439657 -1.134323 1.879803
H 6.749757 -0.125895 2.548360
H 6.348513 -0.030265 0.808558
H 0.839414 0.443905 0.502587
H 2.707289 2.181602 -2.965093
H 1.676095 2.032404 -1.498335
H -0.386029 -3.220552 -2.079437
H -2.447685 2.874241 1.024000
H -3.863228 -1.423586 1.054595
H 0.699349 1.675248 -4.429115
H -0.331676 1.540595 -2.970426
H 0.398460 3.122206 -3.414665
H -2.198940 -4.740015 -1.213145
H -3.965771 -3.828177 0.333348
H -4.777774 2.896055 0.049871
H -4.742562 3.849464 1.566486
H -5.432893 2.196245 1.562225
H -1.997622 1.673197 3.168918
H -3.046945 3.084892 3.487499
H -3.759842 1.443387 3.438652


