%chk=000169121.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169121

0 1
 P    2.569000      0.9890000      -1.997400    
 P    4.591600     -0.9191000      -1.056100    
 P    4.774000      -1.152600       1.816000    
 O  -0.7215000       1.721000     -0.7187000    
 O   -2.653500       3.701400      0.9059000    
 O  -0.2802000       3.700200       2.247400    
 O    1.988000       2.306500      -1.259000    
 O    3.709600      0.4353000     -0.9939000    
 O    1.385000     -0.1051000      -1.860000    
 O    3.044400       1.215400      -3.403400    
 O   -4.472600      -3.792000      0.3357000    
 O    5.406700     -0.9071000      0.3454000    
 O    3.512500      -2.105200     -0.8188000    
 O    3.633800      -2.273300       1.555900    
 O    5.445500      -1.061100      -2.281100    
 O    3.946200      0.2045000       2.114000    
 O    5.775300      -1.509400       2.875600    
 N   -2.400000      0.2140000      2.0300001E-02
 N   -4.795500      0.1876000     -0.4009000    
 N   -2.150600      -1.977800      0.4391000    
 N   -5.811000      -1.980400     -0.2110000    
 N   -7.065000     -6.1799999E-02 -0.7607000    
 C   -2.058800       2.426900       1.145000    
 C  -0.5831000       2.561600       1.470200    
 C   -2.047800       1.623700     -0.1569000    
 C   4.6900000E-02   2.627200      8.9699998E-02
 C    1.509000       2.218800      7.1500003E-02
 C   -3.618200     -0.3647000     -9.6900001E-02
 C   -1.537900     -0.8094000      0.3477000    
 C   -3.457900      -1.695200      0.1588000    
 C   -4.593900      -2.594000      0.1103000    
 C   -5.882900     -0.6828000     -0.4456000    
 C    2.793100      -2.142500      0.4119000    
 H   -2.620000       1.957700       1.959500    
 H  -0.2496000       1.663700       2.005100    
 H   -2.740200       2.030500     -0.9026000    
 H  -5.6100000E-02   3.627400     -0.3509000    
 H    1.628300       1.198600      0.4501000    
 H    2.112200       2.886700      0.6935000    
 H   -3.582500       3.546700      0.6634000    
 H   0.6836000       3.727000       2.370200    
 H  -0.4814000     -0.6470000      0.5126000    
 H   -4.919700       1.177200     -0.5877000    
 H   0.6191000     -5.5000000E-02  -2.470800    
 H   -7.107700      0.9356000     -0.9392000    
 H   -7.931500     -0.5848000     -0.8253000    
 H    2.126700      -3.008500      0.3843000    
 H    2.178300      -1.244400      0.5139000    
 H    4.434500       1.005800       2.399300    


%chk=000169121-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169121

0 1
P 0.793010 0.831313 -2.813276
P 2.500906 -1.331083 -1.179650
P 3.134378 -1.395992 1.900629
O -1.101396 2.562103 -0.526080
O -2.161374 4.220309 1.830177
O 0.427881 4.711098 1.812021
O 1.494100 2.219496 -2.009253
O 1.102888 -0.443488 -1.620638
O -0.870802 0.999873 -2.578116
O 1.310628 0.590704 -4.273095
O -1.912405 -3.906752 0.075168
O 2.678917 -0.596989 0.428040
O 1.957255 -2.916659 -0.764665
O 2.573497 -3.011153 1.584358
O 3.743885 -1.259998 -2.135295
O 1.987170 -0.564421 2.902285
O 4.617447 -1.329007 2.423533
N -1.802392 0.695135 0.855447
N -3.477303 -0.151105 -0.832528
N -0.947219 -1.334977 1.458216
N -3.500860 -2.576528 -1.052539
N -4.951262 -1.255424 -2.323101
C -1.374985 3.002076 1.817188
C 0.115003 3.327889 1.437061
C -1.903514 2.134961 0.657437
C 0.188896 3.202513 -0.106164
C 1.405161 2.368415 -0.540696
C -2.484417 -0.286271 0.123842
C -0.856550 -0.018458 1.644707
C -1.967840 -1.526051 0.507692
C -2.423167 -2.771802 -0.135676
C -3.951146 -1.377097 -1.382747
C 1.471860 -3.183001 0.609256
H -1.454674 2.483650 2.791768
H 0.804894 2.616423 1.930132
H -2.946985 2.414800 0.438686
H 0.202203 4.201001 -0.572509
H 1.425164 1.379275 -0.045134
H 2.321983 2.919907 -0.265133
H -1.519565 4.980679 1.929709
H 0.976750 4.744073 2.633882
H -0.133861 0.455551 2.303156
H -3.668093 0.737194 -1.300669
H -1.079427 1.650654 -1.803596
H -5.408312 -0.377466 -2.554267
H -5.257106 -2.117835 -2.768235
H 1.240139 -4.254896 0.613551
H 0.606265 -2.548981 0.880515
H 2.168575 -0.696858 3.870005


