%chk=000171147.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171147

0 1
 P    2.600900       1.462700      8.3400004E-02
 O  -0.7207000      -2.062200     -0.8140000    
 O    2.215900     -5.2200001E-02 -0.3184000    
 O   0.3161000      0.6717000      -2.134700    
 O   0.9648000      -4.273100     -0.3173000    
 O    4.201000       1.565600     -0.1457000    
 O    2.459000       1.499700       1.695400    
 O    1.799200       2.515400     -0.6268000    
 N   -2.400900     -0.5458000     -9.8399997E-02
 N   -3.623300     -0.6926000       1.762300    
 N   -3.873400      0.8316000      -1.453800    
 N   -5.913600       1.407000     -0.2445000    
 N   -6.332500      0.6684000       1.992900    
 C   0.9026000     -0.5217000     -0.1010000    
 C  -0.1538000      0.2695000     -0.8491000    
 C   -1.282500     -0.7485000      -1.020900    
 C   0.6997000      -1.925300     -0.6447000    
 C    1.214300      -3.013100      0.2809000    
 C   -3.541300      0.1699000     -0.3352000    
 C   -2.498600      -1.044400       1.174800    
 C   -4.284600      6.6699997E-02  0.8299000    
 C   -5.513400      0.7186000      0.8517000    
 C    5.036200      0.6117000      0.4875000    
 C    6.484600      0.9099000      0.1270000    
 C   -5.081000       1.420400      -1.313400    
 C    7.442100     -9.2799999E-02  0.7648000    
 C    8.883300      0.1828000      0.3674000    
 H   0.6813000     -0.5029000      0.9733000    
 H  -0.4586000       1.173800     -0.3127000    
 H   -1.703300     -0.7357000      -2.033000    
 H    1.160800      -2.041900      -1.634000    
 H    2.290700      -2.915500      0.4495000    
 H   0.7014000      -2.996000       1.248000    
 H  -0.4138000       1.137500      -2.577300    
 H   -1.724800      -1.650900       1.625300    
 H   6.0999999E-03  -4.343800     -0.4641000    
 H    4.898000      0.6677000       1.571900    
 H    4.760500     -0.3923000      0.1490000    
 H    1.568300       1.613100       2.090500    
 H    6.736600       1.930000      0.4426000    
 H    6.594800      0.8984000     -0.9647000    
 H   -5.433100       1.980900      -2.172800    
 H    7.353600     -4.9300000E-02   1.856500    
 H    7.174700      -1.110600      0.4579000    
 H   -7.220600       1.151200       1.984700    
 H   -6.035700      0.1563000       2.812500    
 H    9.011700      0.1124000     -0.7175000    
 H    9.193600       1.182900      0.6862000    
 H    9.551800     -0.5460000      0.8363000    


%chk=000171147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171147

0 1
P 2.478047 1.457237 -0.952462
O -0.811304 -2.380245 -0.452515
O 2.038125 -0.113366 -0.431491
O 0.310549 -0.326858 -2.735043
O 0.683828 -3.978787 1.417946
O 4.167548 1.340589 -0.994903
O 2.075509 2.413627 0.432173
O 1.827448 1.972817 -2.311918
N -2.692585 -0.971956 -0.888188
N -4.987528 -0.980612 -0.741826
N -2.175496 0.432211 1.111616
N -4.217560 1.152970 2.279394
N -6.387500 0.557064 1.557272
C 0.615178 -0.475580 -0.224373
C -0.333798 -0.192556 -1.441614
C -1.363687 -1.356667 -1.360454
C 0.579329 -2.003725 -0.063856
C 0.791514 -2.520052 1.358888
C -3.014549 -0.209278 0.244727
C -3.917407 -1.413135 -1.426433
C -4.433540 -0.224170 0.310204
C -5.032731 0.496549 1.384973
C 4.931163 0.788888 0.180287
C 6.408082 0.954328 -0.169257
C -2.865294 1.086752 2.095789
C 7.322043 0.402729 0.953094
C 8.819202 0.565162 0.612982
H 0.221159 0.046978 0.664923
H -0.825095 0.792131 -1.328923
H -1.478388 -1.781077 -2.373581
H 1.291429 -2.471467 -0.770385
H 1.815179 -2.283800 1.694627
H 0.058372 -2.031347 2.035022
H 0.845916 0.504625 -2.913313
H -3.954450 -2.041045 -2.314604
H -0.198644 -4.227802 1.039873
H 4.651083 1.360607 1.085382
H 4.647116 -0.271236 0.306662
H 1.784625 3.336284 0.214681
H 6.623762 2.025774 -0.340538
H 6.614785 0.424522 -1.118068
H -2.260131 1.624858 2.831550
H 7.100280 0.926586 1.904962
H 7.095518 -0.669064 1.122959
H -6.762775 1.083010 2.343956
H -7.003864 0.073941 0.906913
H 9.075026 0.026089 -0.318078
H 9.080194 1.629997 0.467787
H 9.458418 0.166702 1.421384


