%chk=000165419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165419

0 1
 P   0.4638000      -3.457000      0.2625000    
 P   -2.051200      -2.001200     -0.2072000    
 P   -3.547900      0.5104000     -0.6017000    
 O    1.765900     -0.2838000     -0.8542000    
 O    4.952400      0.2030000      0.7250000    
 O    4.164200       1.582500      -1.517800    
 O    1.979800      -2.980700     -4.2900000E-02
 O  -0.4488000      -2.184000     -0.1329000    
 O   0.4961000       3.589100      -1.494900    
 O   0.1349000      -4.525400     -0.9069000    
 O   0.2327000      -3.970700       1.653900    
 O   -2.098100       3.036400       2.267200    
 O   -2.233700     -0.4265000     -0.5193000    
 O   -2.528000      -2.137800       1.331300    
 O   -2.754900      -2.913800      -1.167900    
 O   -2.957000       1.925300      -1.113100    
 O   -4.338000     -5.6499999E-02  -1.892500    
 O   -4.350500      0.5748000      0.6643000    
 N   0.8100000       1.724200     -0.1482000    
 N   0.4538000       1.006800      0.9661000    
 N  -0.8153000       3.369200      0.3548000    
 C    3.569100      0.3833000      0.5103000    
 C    3.249100       1.532100     -0.4253000    
 C    2.943900     -0.7990000     -0.2106000    
 C    1.866500       1.150100     -0.9376000    
 C    2.561100      -1.936900      0.7195000    
 C   0.1884000       2.933200     -0.4961000    
 C  -0.4844000       1.445700       1.731500    
 C   -1.223800       2.706900       1.482400    
 H    3.085500      0.5437000       1.481100    
 H    3.601900      -1.187700     -0.9978000    
 H    3.289200       2.506200      7.1099997E-02
 H    1.730500       1.436300      -1.986400    
 H    1.848200      -1.597800       1.479200    
 H    3.442400      -2.336900       1.230100    
 H    5.303300       1.036900       1.081600    
 H    4.098700      0.7517000      -2.017500    
 H   -1.281400       4.241600      0.1235000    
 H  -0.7884000      0.8856000       2.629600    
 H   0.4651000      -5.444600     -0.8160000    
 H   -2.592400      -3.031400       1.730500    
 H   -3.552900       2.703500      -1.151100    
 H   -5.223600      0.3078000      -2.105000    


%chk=000165419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165419

0 1
P 0.140155 -3.533355 0.031575
P -2.657985 -2.128137 -0.129103
P -3.590614 0.692176 -1.109093
O 1.589202 0.079349 -0.845746
O 5.029056 -0.022127 0.289254
O 4.118366 1.731159 -1.569563
O 1.655770 -2.848237 -0.307377
O -1.057476 -2.562941 -0.759569
O -0.727016 2.224248 -1.490353
O 0.230350 -4.956850 -0.868076
O -0.265453 -3.741834 1.562756
O -1.844322 3.312556 2.944441
O -2.583630 -0.426530 -0.090530
O -2.633644 -2.636776 1.465125
O -3.856300 -2.614664 -1.057235
O -2.682742 0.841793 -2.515147
O -4.932207 -0.208023 -1.537864
O -3.814306 2.006651 -0.253041
N 0.899869 2.143991 0.176513
N 1.300481 2.212435 1.504161
N -1.324482 2.757231 0.717507
C 3.623932 0.374392 0.428287
C 3.324918 1.694509 -0.348579
C 2.753665 -0.664219 -0.321802
C 1.854468 1.536215 -0.774546
C 2.264980 -1.794739 0.567857
C -0.425483 2.376115 -0.268859
C 0.412960 2.616405 2.395175
C -1.001516 2.941464 2.091201
H 3.323373 0.487165 1.486338
H 3.336031 -1.072393 -1.169564
H 3.495320 2.595652 0.267374
H 1.660893 1.960986 -1.769188
H 1.528677 -1.434670 1.309433
H 3.113599 -2.283987 1.076399
H 5.564419 0.331105 1.042834
H 4.950545 1.210550 -1.392249
H -2.340170 2.756388 0.437144
H 0.745127 2.686156 3.433774
H 0.651250 -4.893607 -1.764449
H -1.775106 -3.134362 1.767974
H -1.855109 1.424570 -2.347854
H -4.773643 -1.221213 -1.552733


