%chk=000004392.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004392

0 1
 P    4.630700       1.555700      4.9300000E-02
 O    1.083700     -0.6862000       1.059800    
 O  -0.7174000      -2.821600      -1.202200    
 O    1.238100      -3.676000      0.4805000    
 O    3.617700      0.4374000      0.6366000    
 O    3.821000       2.189100      -1.199100    
 O    5.777300      0.6661000     -0.6639000    
 O    5.133200       2.547300       1.057500    
 N  -0.9854000      4.3099999E-02  0.1559000    
 N   -1.533600       2.137200     -0.3610000    
 C   0.2721000      -1.892400     -0.8098000    
 C  -0.1394000      -1.115900      0.4317000    
 C    1.554100      -2.552400     -0.3415000    
 C    2.179600      -1.466800      0.5287000    
 C    3.097700     -0.5364000     -0.2515000    
 C   -2.357800      8.0600001E-02  0.1724000    
 C  -0.5416000       1.296900     -0.1683000    
 C   -2.674400       1.396600     -0.1532000    
 C   -3.318700     -0.8961000      0.4366000    
 C   -4.024800       1.778700     -0.2243000    
 C   -5.006600      0.8148000      3.7000000E-02
 C   -4.657700     -0.4983000      0.3615000    
 C   -6.447900       1.198700     -3.2600001E-02
 H   0.4749000      -1.219900      -1.651300    
 H  -0.6768000      -1.740700       1.154800    
 H    2.186200      -2.904500      -1.161600    
 H    2.715200      -1.881100       1.390400    
 H    2.546300     -2.4100000E-02  -1.045900    
 H    3.920600      -1.104700     -0.6958000    
 H  -0.8566000      -3.441500     -0.4662000    
 H    2.078400      -4.046200      0.8008000    
 H   0.5081000       1.542100     -0.2552000    
 H   -3.052500      -1.916700      0.6864000    
 H   -4.292700       2.799700     -0.4785000    
 H   -5.432200      -1.236400      0.5595000    
 H   -6.839300       1.006200      -1.036500    
 H   -7.042100      0.6315000      0.6919000    
 H   -6.587600       2.259800      0.2002000    
 H    4.210900       2.949200      -1.681000    
 H    6.570400       1.115700      -1.025700    


%chk=000004392-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004392

0 1
P 3.652359 1.652484 0.659123
O 1.355775 -0.757484 0.758651
O -0.438670 -3.174830 -1.363159
O 1.284654 -3.909458 0.502797
O 4.265974 0.032100 0.473496
O 2.305618 1.518163 1.675737
O 2.999077 1.856188 -0.948043
O 4.732493 2.705126 1.108619
N -0.657979 -0.074170 -0.341813
N -1.119575 1.878741 -1.452270
C 0.564482 -2.207074 -0.993307
C 0.084474 -1.220126 0.116267
C 1.827158 -2.850053 -0.362865
C 2.476526 -1.702519 0.442265
C 3.577324 -0.975881 -0.349415
C -2.021902 0.203707 -0.087729
C -0.182559 0.969176 -1.168763
C -2.290629 1.420344 -0.793617
C -3.020522 -0.467182 0.645524
C -3.582800 1.990896 -0.761649
C -4.598245 1.342428 -0.025000
C -4.299448 0.124627 0.666484
C -6.004143 1.917008 0.040973
H 0.816989 -1.646195 -1.908575
H -0.518210 -1.764345 0.865213
H 2.508771 -3.274333 -1.124231
H 2.884040 -2.055612 1.406610
H 3.180341 -0.511612 -1.271404
H 4.375176 -1.694048 -0.610942
H -0.391287 -3.907966 -0.688936
H 1.998590 -4.512340 0.822358
H 0.864774 1.040611 -1.460561
H -2.834538 -1.406780 1.176363
H -3.781121 2.920694 -1.304209
H -5.100859 -0.367969 1.230586
H -6.293941 2.154090 1.082106
H -6.088376 2.844922 -0.549706
H -6.751008 1.200445 -0.349900
H 1.733297 0.697501 1.468867
H 2.919022 2.799226 -1.239547


