%chk=000169008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169008

0 1
 P    2.898000      6.7000002E-02  -2.462700    
 O   -1.122900       1.486300      -1.778900    
 O   -2.406000       2.702700       1.350800    
 O   -1.336700       4.283400     -0.5840000    
 O    1.564700      0.9837000      -2.400800    
 O    2.740700     -0.9799000      -1.236900    
 O    4.079300       1.050100      -1.955000    
 O    3.161300     -0.5690000      -3.797500    
 O    2.153700       2.726300       2.869800    
 N   -2.586100      0.1225000     -0.5022000    
 N   -2.539100      -2.101200     -0.3510000    
 N   -4.899400      0.5335000      0.1144000    
 N   -6.071800      -1.551700      0.5974000    
 N   -5.002900      -3.688400      0.4589000    
 N    3.816400      -4.313200     -0.2021000    
 C   -1.456000       2.129100      0.4760000    
 C  -0.5569000       3.157600     -0.1810000    
 C   -2.115400       1.486000     -0.7346000    
 C  -7.6399997E-02   2.420700      -1.427300    
 C    1.208300       1.637700      -1.195500    
 C   -3.842000     -0.2572000     -0.1226000    
 C   -1.840500      -1.019800     -0.6271000    
 C   -3.791900      -1.639200     -3.4000002E-02
 C   -4.963600      -2.288300      0.3423000    
 C    3.295700      -2.963600      3.7400000E-02
 C    3.605300      -2.102000      -1.192800    
 C    3.933400      -2.422900       1.334600    
 C   -5.972300     -0.2065000      0.4694000    
 C    3.459200      -1.049400       1.744000    
 C    4.129700      8.5299999E-02   1.287400    
 C    2.350000     -0.9153000       2.579100    
 C    3.691000       1.354100       1.665900    
 C    1.911300      0.3534000       2.957500    
 C    2.581900       1.488100       2.501000    
 H  -0.8509000       1.405400       1.035500    
 H   0.2406000       3.519500      0.4741000    
 H   -2.977000       2.063800      -1.091100    
 H   4.6300001E-02   3.090600      -2.285800    
 H    1.068200      0.8768000     -0.4218000    
 H    2.016100       2.312100     -0.8967000    
 H   -2.978100       1.986400       1.674500    
 H  -0.7402000       4.900200      -1.041800    
 H  -0.7977000      -1.009100     -0.9143000    
 H    2.208400      -3.022200      0.1737000    
 H    3.429600      -2.677400      -2.109500    
 H    4.649400      -1.769500      -1.203000    
 H    3.733700      -3.118500       2.162000    
 H    5.028100      -2.403200       1.236400    
 H   -6.878100      0.3513000      0.6815000    
 H    5.010600      0.7526000      -2.034400    
 H   -4.177400      -4.240300      0.2688000    
 H   -5.866200      -4.136800      0.7336000    
 H    3.585400      -4.914600      0.5878000    
 H    3.354700      -4.720400      -1.014400    
 H    4.999800     -4.3000001E-03  0.6429000    
 H    1.817400      -1.791900       2.938500    
 H    4.217300       2.234300       1.306700    
 H    1.044500      0.4446000       3.606700    
 H    1.371000       2.632200       3.439600    


%chk=000169008-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169008

0 1
P 3.131480 -0.239972 -2.917911
O -0.884061 1.535946 -2.071786
O -1.778634 2.330338 1.439811
O -0.805740 4.194782 -0.444118
O 1.817192 0.856393 -2.808657
O 3.049972 -0.968250 -1.366619
O 4.568449 0.717418 -2.716186
O 3.120549 -1.141156 -4.218407
O 0.498859 2.451618 2.919695
N -2.547472 0.255910 -0.951404
N -3.464524 -1.734405 -1.630691
N -3.503549 0.373033 1.344932
N -4.930690 -1.546382 1.853276
N -5.320867 -3.297271 0.318902
N 4.246388 -4.092277 0.203901
C -1.037493 1.855057 0.281422
C -0.080139 2.941202 -0.256804
C -1.868066 1.565336 -0.991940
C 0.298903 2.367114 -1.637945
C 1.555155 1.507095 -1.501078
C -3.317128 -0.202191 0.113433
C -2.673667 -0.699286 -1.977259
C -3.878432 -1.430028 -0.321022
C -4.718468 -2.109231 0.610110
C 3.506820 -2.812328 0.204717
C 4.026098 -2.043219 -1.028159
C 3.790648 -2.101762 1.561076
C -4.327496 -0.365775 2.152914
C 2.910447 -0.908745 1.903804
C 3.455117 0.393744 2.042728
C 1.525580 -1.075352 2.166085
C 2.650161 1.498095 2.395488
C 0.705009 0.015913 2.524298
C 1.262290 1.320584 2.618507
H -0.466181 0.939912 0.531083
H 0.792327 3.083651 0.406691
H -2.617772 2.363290 -1.166606
H 0.425257 3.158092 -2.394349
H 1.443300 0.727272 -0.728663
H 2.412610 2.156552 -1.236402
H -2.571061 1.645429 1.587615
H -1.310043 4.361438 0.396723
H -2.151524 -0.580811 -2.922555
H 2.403817 -2.928844 0.087943
H 4.109778 -2.731832 -1.891484
H 5.011895 -1.588740 -0.825231
H 3.661586 -2.871210 2.352736
H 4.858766 -1.814921 1.578494
H -4.521264 0.038312 3.150083
H 5.010934 0.951342 -3.572179
H -5.178212 -3.728116 -0.592955
H -5.913744 -3.738303 1.019798
H 4.274784 -4.575152 1.105192
H 4.041400 -4.719781 -0.578521
H 4.525841 0.550442 1.864122
H 1.079503 -2.076197 2.103512
H 3.073333 2.502543 2.497772
H -0.357182 -0.139961 2.751465
H -0.465338 2.365144 2.610005


