%chk=000171796.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171796

0 1
 P    2.948500      0.1682000      0.4609000    
 O    1.646600     -0.7769000      0.3141000    
 O    3.039100      0.9404000     -0.9613000    
 O    4.183400     -0.8822000      0.4173000    
 O   -2.544500      -3.094800     -0.1380000    
 O    2.956400       1.054800       1.674300    
 O   -3.786700       2.314000     -7.8800000E-02
 O   -4.534000      0.2541000     -0.2109000    
 N   -3.593500       1.075500     -9.9900000E-02
 C   -1.997600     -0.7835000     -1.4100000E-02
 C   0.3576000     -0.3279000      0.2125000    
 C   -2.262200      0.5859000      5.4000001E-03
 C  -0.6842000      -1.241800      8.9699998E-02
 C   9.9900000E-02   1.039100      0.2324000    
 C   -1.213600       1.497100      0.1287000    
 C   -3.098400      -1.786000     -0.1458000    
 C    4.174000       1.749000      -1.218400    
 C    4.309200      -1.784900     -0.6680000    
 H  -0.4270000      -2.296800      7.9300001E-02
 H   0.8817000       1.784200      0.3223000    
 H   -1.378700       2.571400      0.1467000    
 H   -3.781500      -1.744600      0.7080000    
 H   -3.617700      -1.686300      -1.103800    
 H   -3.284000      -3.720300     -0.2249000    
 H    4.078300       2.179200      -2.218300    
 H    5.087400       1.151000      -1.173700    
 H    4.224900       2.558300     -0.4854000    
 H    4.366400      -1.244200      -1.615500    
 H    3.459300      -2.471800     -0.6831000    
 H    5.227400      -2.362600     -0.5356000    


%chk=000171796-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171796

0 1
P 3.155068 0.310707 0.341403
O 1.715527 -0.671196 0.451443
O 3.185963 0.521669 -1.373571
O 4.306559 -0.879861 0.735085
O -2.198278 -2.950945 -0.982007
O 3.264802 1.630551 1.206711
O -3.894298 2.334548 0.608401
O -4.593826 0.308526 -0.159339
N -3.660307 1.117882 0.240324
C -1.934770 -0.702741 -0.138705
C 0.399688 -0.163915 0.388483
C -2.271826 0.623073 0.273826
C -0.574618 -1.070909 -0.073013
C 0.058652 1.144864 0.810443
C -1.287992 1.528809 0.740981
C -2.936741 -1.727521 -0.647035
C 3.877328 1.719416 -1.923299
C 4.292459 -2.203412 0.053184
H -0.287795 -2.074378 -0.391162
H 0.819949 1.831147 1.193866
H -1.607047 2.526292 1.053004
H -3.703389 -1.917682 0.130629
H -3.471327 -1.324098 -1.530242
H -2.836681 -3.635693 -1.298252
H 3.525341 1.783881 -2.962979
H 4.971527 1.577164 -1.895110
H 3.597169 2.626063 -1.359993
H 4.365175 -2.076978 -1.041019
H 3.375935 -2.754335 0.319163
H 5.184255 -2.713328 0.444881


