%chk=000165838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165838

0 1
 P   -4.650000      -1.489500     -0.1349000    
 O   -1.358400      0.9656000       1.192300    
 O   0.5877000       3.045100     -0.9849000    
 O   -1.522000       3.880900      0.5259000    
 O   -3.770800     -0.2986000      0.5213000    
 O    4.133800      -2.812200     -0.2156000    
 O   -3.660400      -2.132500      -1.240400    
 O   -5.734500     -0.6883000      -1.027600    
 O   -5.232800      -2.462400      0.8479000    
 N   0.6933000      0.1589000      0.3214000    
 N    1.298900      -2.039900      0.1648000    
 N    3.048200       1.033300      7.6300003E-02
 N    4.757300     -0.5933000     -0.2018000    
 N    5.236900       1.711800     -0.1581000    
 C  -9.1600001E-02   1.330900      0.6151000    
 C  -0.4085000       2.096600     -0.6598000    
 C   -1.731200       2.749400     -0.3185000    
 C   -2.416200       1.669000      0.5060000    
 C   0.1124000      -1.194800      0.3781000    
 C    2.075700      7.7900000E-02  0.1464000    
 C   -3.185200      0.6624000     -0.3392000    
 C    2.411400      -1.223600      5.0099999E-02
 C    1.213600      -3.474900      0.1674000    
 C    3.828000      -1.627200     -0.1332000    
 C    4.364500      0.6556000     -9.9100001E-02
 H   0.4338000       1.959300       1.344600    
 H  -0.5400000       1.421000      -1.514300    
 H   -2.302900       3.080800      -1.190000    
 H   -3.070800       2.087200       1.278900    
 H  -0.6204000      -1.343300     -0.4212000    
 H  -0.3303000      -1.401900       1.358300    
 H   -2.520500      0.1460000      -1.037600    
 H   -3.970500       1.172000     -0.9061000    
 H    1.378300       2.553400      -1.263200    
 H  -0.9784000       4.514900      2.7600000E-02
 H    2.776600       2.002600      0.1867000    
 H   0.1729000      -3.809400      0.2326000    
 H    1.754500      -3.890700       1.023300    
 H    1.638600      -3.889200     -0.7523000    
 H    6.232200       1.564200     -0.2851000    
 H    4.913800       2.669700     -7.7900000E-02
 H   -3.951200      -2.930700      -1.730800    
 H   -6.454300      -1.191600      -1.464400    


%chk=000165838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165838

0 1
P -3.675485 -1.072850 1.498553
O -1.191224 1.148960 0.505658
O 0.008250 2.629958 -2.671608
O -1.283530 4.040936 -0.784520
O -4.043281 0.622602 1.227807
O 4.048259 -3.087108 0.084341
O -2.080435 -1.197065 0.962725
O -4.464638 -1.884900 0.191080
O -4.112972 -1.544181 2.940242
N 0.755986 0.194263 -0.678556
N 1.556809 -1.909607 -1.305452
N 2.460764 0.605621 1.123805
N 4.140484 -1.114699 1.377880
N 4.213091 0.814923 2.712588
C -0.031146 1.348139 -0.520881
C -0.806477 1.834323 -1.763811
C -1.885814 2.766091 -1.165390
C -2.331704 2.053021 0.131510
C 0.336400 -1.062257 -1.396359
C 1.840030 -0.182073 0.160970
C -3.630399 1.248291 -0.044283
C 2.321943 -1.418600 -0.211048
C 1.375489 -3.353744 -1.526207
C 3.541682 -1.964696 0.400299
C 3.624198 0.056832 1.713316
H 0.573674 2.179684 -0.114714
H -1.282147 0.978865 -2.283153
H -2.722105 2.923169 -1.875059
H -2.449090 2.793008 0.940529
H 0.071490 -0.851512 -2.449026
H -0.533546 -1.537668 -0.879283
H -3.541936 0.489360 -0.847852
H -4.447112 1.946331 -0.300826
H 0.792963 2.109373 -2.977508
H -0.724231 4.342376 -1.550181
H 1.968310 1.386428 1.562467
H 1.100381 -3.541247 -2.579409
H 0.586342 -3.781063 -0.867309
H 2.331650 -3.853199 -1.304306
H 5.023835 0.398540 3.164705
H 4.009672 1.800248 2.858608
H -1.595303 -0.277170 0.881026
H -5.287623 -2.363203 0.467631


