%chk=000080098.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080098

0 1
 P    2.743400       2.198900     -0.2516000    
 P    3.115100      -2.094300     -0.1795000    
 O    2.638600       1.441500      -1.676600    
 O    4.255200       2.776900     -0.2673000    
 O    2.201100      -2.228600      -1.507200    
 O    3.250000      -3.629600      0.3154000    
 O    1.692600       3.241000     -9.4999997E-03
 O    4.429100      -1.399800     -0.3778000    
 N    1.762200     -2.8700000E-02  0.5603000    
 C  -0.6680000     -0.1286000      0.2572000    
 C   -2.020300      0.3583000      0.7847000    
 C   0.4843000      0.4396000       1.083800    
 C   -3.173200     -0.1826000     -6.4000003E-02
 C   -4.553800      0.2563000      0.4350000    
 C    2.848200      0.8798000      0.9480000    
 C    2.016000      -1.392500       1.040700    
 C   -5.704000     -0.2646000     -0.4308000    
 C   -7.084700      0.1242000      0.1043000    
 C   -8.231800     -0.3672000     -0.7651000    
 H  -0.6673000      -1.223800      0.2634000    
 H  -0.5545000      0.1831000     -0.7892000    
 H   -2.048200       1.454600      0.7797000    
 H   -2.147900      3.5100002E-02   1.824900    
 H   0.3678000      0.1737000       2.143400    
 H   0.3993000       1.528700       1.045100    
 H   -3.045000      0.1511000      -1.101300    
 H   -3.131000      -1.278800     -7.6700002E-02
 H   -4.689400     -9.5600002E-02   1.465100    
 H   -4.595300       1.352000      0.4663000    
 H    2.749800       1.249800       1.975000    
 H    3.837400      0.4298000      0.8704000    
 H    2.456800      -1.404300       2.044100    
 H    1.120200      -2.019500       1.068400    
 H   -5.640800      -1.357700     -0.4964000    
 H   -5.589200      0.1212000      -1.451200    
 H   -7.147400       1.215800      0.1872000    
 H   -7.208800     -0.2791000       1.116400    
 H   -8.223200      -1.459100     -0.8413000    
 H   -8.161500      4.8200000E-02  -1.775300    
 H   -9.191600     -6.2399998E-02 -0.3367000    
 H    2.554100       1.977500      -2.493700    
 H    4.460300       3.551400     -0.8331000    
 H    2.605100      -2.584400      -2.327100    
 H    3.841600      -4.236200     -0.1787000    


%chk=000080098-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080098

0 1
P 2.428799 1.974013 -0.719753
P 3.156410 -2.125706 -0.154091
O 2.201398 0.717458 -1.959883
O 3.988862 2.669892 -1.037141
O 2.082262 -1.838517 -1.452385
O 2.944957 -3.816462 0.129566
O 1.237111 3.035737 -0.787367
O 4.653853 -1.606374 -0.365076
N 1.903704 -0.046719 1.266039
C -0.545256 -0.035170 0.567969
C -1.981350 0.217082 1.079726
C 0.516066 0.309405 1.640336
C -3.059839 -0.075917 0.012577
C -4.501220 0.130666 0.530284
C 2.832669 0.971465 0.911489
C 2.331202 -1.432636 1.405426
C -5.579846 -0.134652 -0.544072
C -7.022831 0.054923 -0.022592
C -8.093376 -0.201465 -1.105413
H -0.433815 -1.095021 0.263821
H -0.362469 0.576548 -0.336491
H -2.076337 1.271790 1.412371
H -2.171399 -0.413116 1.974602
H 0.257700 -0.198351 2.593058
H 0.491159 1.398380 1.841406
H -2.888265 0.578549 -0.866904
H -2.945216 -1.119235 -0.348340
H -4.678050 -0.537545 1.399293
H -4.609925 1.168623 0.909025
H 2.886855 1.807252 1.637398
H 3.845753 0.567082 0.735419
H 3.074694 -1.581561 2.213512
H 1.456262 -2.069579 1.606132
H -5.465138 -1.168026 -0.933528
H -5.412018 0.542655 -1.407554
H -7.134173 1.085248 0.373153
H -7.192314 -0.627254 0.835547
H -8.020972 -1.233865 -1.496863
H -7.965469 0.489747 -1.959880
H -9.115474 -0.061710 -0.707648
H 1.793822 1.060989 -2.795061
H 3.967176 3.538494 -1.517090
H 2.124410 -0.866452 -1.775407
H 3.430925 -4.409565 -0.496911


