%chk=000002243.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002243

0 1
 P    4.146200     -0.2792000      -1.467300    
 O   0.2951000     -0.9269000     -0.4238000    
 O   -1.545300      -2.508000       2.188200    
 O   0.5753000      -4.292200      0.7867000    
 O    2.879600      -1.286100      -1.513200    
 O    3.654900      0.9512000     -0.5393000    
 O    4.179000      0.3530000      -2.956700    
 O    5.443000     -0.8986000      -1.032100    
 O    1.699000       1.482600      -1.601700    
 O    1.623000      0.4866000       3.172400    
 O    3.614500       1.461500       2.691000    
 N   -2.041900     -0.5645000     -0.3631000    
 N   -3.376400     -0.2200000      -2.115300    
 N   -3.373200      0.4715000       1.384800    
 N   -5.458000       1.374500      0.4935000    
 N   -6.040900       1.215200      -1.822100    
 N    1.739100       3.893000     -0.2333000    
 C  -0.9866000      -2.454800      0.8873000    
 C   0.4640000      -2.885300      0.8867000    
 C  -0.8815000      -1.014200      0.4030000    
 C   0.9912000      -2.183000     -0.3537000    
 C    2.487900      -1.931400     -0.3138000    
 C   -3.135400      9.7300000E-02  0.1187000    
 C   -2.233000     -0.7312000      -1.709100    
 C   -3.950600      0.3010000     -0.9831000    
 C   -5.152100      0.9669000     -0.7619000    
 C   -4.562700       1.105500       1.474300    
 C    2.420200       2.742800      0.3655000    
 C    2.518900       1.680600     -0.7156000    
 C    1.597300       2.221200       1.548600    
 C    2.409400       1.371000       2.504200    
 H   -1.598700      -3.081400      0.2285000    
 H   0.9772000      -2.560700       1.799300    
 H  -0.7542000     -0.3063000       1.230100    
 H   0.7425000      -2.737800      -1.267500    
 H    3.041900      -2.871400     -0.2297000    
 H    2.743200      -1.296700      0.5419000    
 H  -0.9995000      -1.962200       2.779500    
 H   0.1308000      -4.578000     -2.9400000E-02
 H   -1.515600      -1.234200      -2.343300    
 H   -4.840000       1.445900       2.466300    
 H   -6.907700       1.701100      -1.636100    
 H   -5.814800      0.9123000      -2.759900    
 H    3.370000      0.7798000      -3.311100    
 H    3.425400       3.059100      0.6648000    
 H   0.7461000       1.632300       1.187600    
 H    1.204100       3.052200       2.147300    
 H    2.312600       4.276500     -0.9840000    
 H    1.648600       4.635200      0.4596000    
 H    2.141000     -6.1799999E-02   3.799600    


%chk=000002243-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002243

0 1
P 4.496608 -0.150585 -0.860822
O 0.323515 -1.182466 -0.534653
O -1.803185 -3.312485 1.659377
O 0.853931 -4.706843 0.515764
O 3.224174 -1.272145 -1.161332
O 3.497373 1.184277 -0.071382
O 4.834590 0.441241 -2.402167
O 5.680132 -0.603665 0.070426
O 2.906832 2.239634 -2.064779
O 1.464283 0.157422 2.577763
O 2.339214 2.280684 2.895146
N -2.014663 -0.754347 -0.270206
N -3.680213 -0.280353 -1.777088
N -2.553150 0.940357 1.471857
N -4.534879 2.272728 0.877396
N -5.741995 1.959338 -1.129551
N 0.845669 3.712900 -0.740885
C -0.953391 -2.906279 0.561798
C 0.542071 -3.297557 0.662191
C -0.861247 -1.371773 0.348789
C 1.211209 -2.383051 -0.405849
C 2.619115 -1.978174 0.002403
C -2.756968 0.301500 0.285453
C -2.615803 -1.053146 -1.509040
C -3.783628 0.568686 -0.655896
C -4.702490 1.605676 -0.315510
C -3.492184 1.914758 1.684999
C 1.734547 2.869633 0.045612
C 2.764145 2.094809 -0.819292
C 0.943617 1.840157 0.905100
C 1.666478 1.502034 2.190606
H -1.409383 -3.384177 -0.325672
H 0.918653 -3.042207 1.671237
H -0.701938 -0.850277 1.315068
H 1.238495 -2.883826 -1.393483
H 3.220008 -2.879372 0.224237
H 2.580078 -1.313703 0.885620
H -1.447821 -2.963255 2.516785
H 0.375585 -5.082872 -0.266906
H -2.218648 -1.812703 -2.177675
H -3.398931 2.478782 2.617639
H -6.368098 2.705963 -0.834410
H -5.883496 1.475184 -2.013679
H 4.166174 1.166973 -2.668429
H 2.311406 3.505838 0.744823
H 0.718571 0.920287 0.341912
H -0.016063 2.316739 1.179697
H 0.329768 3.218648 -1.476037
H 1.275679 4.571995 -1.093700
H 1.909154 0.022916 3.460046


