%chk=000016111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016111

0 1
 P   -2.835000     -0.1650000      9.3900003E-02
 O   -3.222300     -0.1151000       1.552500    
 O    1.052800      0.1106000      0.1403000    
 O  -0.4889000       1.493300       1.138600    
 N   -3.232900       1.192600     -0.7758000    
 N   -3.498800      -1.434100     -0.7463000    
 N   -1.132800     -0.3543000     -9.6100003E-02
 C   -4.655000       1.454500     -0.9533000    
 C   -3.824000       2.294900     -2.8300000E-02
 C   -3.290700      -2.762400     -0.1847000    
 C   -4.636700      -2.101100     -0.1272000    
 C  -0.2132000      0.5099000      0.4593000    
 C    2.111200      0.9259000      0.6554000    
 C    3.427500      0.3541000      0.2171000    
 C    4.068400     -0.5878000       1.014300    
 C    3.994200      0.7708000     -0.9822000    
 C    5.291900      -1.119500      0.6070000    
 C    5.217700      0.2389000      -1.389500    
 C    5.866500     -0.7063000     -0.5948000    
 H   -5.364400      0.7703000     -0.5094000    
 H   -4.937900       1.876600      -1.907600    
 H   -3.542900       3.285700     -0.3595000    
 H   -3.975300       2.187800       1.035800    
 H   -2.715300      -2.837200      0.7277000    
 H   -3.144200      -3.556700     -0.9035000    
 H   -5.401100      -2.447900     -0.8097000    
 H   -4.995200      -1.740700      0.8259000    
 H  -0.7776000      -1.134100     -0.6417000    
 H    2.001400       1.952700      0.2843000    
 H    2.056300      0.9551000       1.750800    
 H    3.628700     -0.9185000       1.951300    
 H    3.496400       1.504800      -1.610000    
 H    5.796800      -1.855900       1.225300    
 H    5.665000      0.5601000      -2.325600    
 H    6.818900      -1.120600     -0.9121000    


%chk=000016111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016111

0 1
P -2.912301 -0.410615 0.266974
O -3.426363 -0.390470 1.786087
O 1.032933 0.071357 0.251833
O -0.567842 1.544526 1.156662
N -3.551610 0.865363 -0.813594
N -3.208156 -1.914804 -0.658843
N -1.168595 -0.423959 0.005586
C -4.640096 1.757723 -0.223300
C -3.256503 2.322194 -0.459140
C -3.838365 -3.073478 0.102787
C -4.643361 -2.315673 -0.934222
C -0.272781 0.493515 0.534360
C 2.111930 0.992089 0.758477
C 3.430909 0.454756 0.263801
C 4.180295 -0.453998 1.052583
C 3.938383 0.850606 -0.999531
C 5.413243 -0.962237 0.586365
C 5.170237 0.344249 -1.469350
C 5.910490 -0.563757 -0.676339
H -4.933677 1.562968 0.815732
H -5.450229 1.976852 -0.925122
H -3.066334 2.943119 -1.339901
H -2.620708 2.518039 0.411402
H -4.078045 -2.902527 1.159674
H -3.406628 -4.047229 -0.144840
H -4.798224 -2.739163 -1.930623
H -5.448550 -1.664393 -0.572851
H -0.799049 -1.195964 -0.557477
H 1.895676 2.006240 0.379055
H 2.046598 1.008064 1.860523
H 3.794715 -0.764885 2.031131
H 3.364960 1.553926 -1.615479
H 5.984750 -1.663249 1.204603
H 5.553739 0.657199 -2.446752
H 6.868059 -0.954985 -1.038070


