%chk=000060734.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060734

0 1
 O   -2.872900      -2.140500     -0.8781000    
 O   -4.156500      0.4577000      0.9532000    
 O    1.700400     -0.9978000     -8.7000001E-03
 O  -0.3978000      -2.964700      0.3911000    
 O    2.618100      0.4050000       1.576500    
 N   -1.340400       1.056600      0.1935000    
 C   -2.241000      0.1652000     -0.5458000    
 C   -2.062200      -1.279000     -8.2099997E-02
 C   -3.594100      0.8304000     -0.2988000    
 C   -1.737800       2.408200     -0.1852000    
 C   5.8800001E-02  0.7477000     -6.8499997E-02
 C  -0.5972000      -1.705300     -0.2535000    
 C   -3.264500       2.326800     -0.2646000    
 C   0.3624000     -0.6873000      0.3772000    
 C    2.669600     -0.1789000      0.5027000    
 C    3.821000     -0.1078000     -0.4742000    
 C    4.934100      0.8128000      2.0000000E-02
 C    6.099900      0.8509000     -0.9546000    
 H   -2.035000      0.2273000      -1.625900    
 H   -2.369500      -1.414800      0.9620000    
 H   -4.317000      0.5874000      -1.084300    
 H   -1.333500       2.693700      -1.164600    
 H   -1.413500       3.149500      0.5518000    
 H   0.6803000       1.466500      0.4757000    
 H   0.3082000      0.8721000      -1.131400    
 H  -0.3566000      -1.861800      -1.311700    
 H   -3.729100       2.829400      0.5910000    
 H   -3.608400       2.817700      -1.181800    
 H   0.2956000     -0.7678000       1.471400    
 H   -3.799600      -1.879400     -0.7422000    
 H   -4.999900      0.9325000       1.047600    
 H  -0.6176000      -2.860500       1.332500    
 H    4.212400      -1.121900     -0.6126000    
 H    3.435500      0.2603000      -1.431700    
 H    4.544200       1.828000      0.1604000    
 H    5.293600      0.4739000      0.9989000    
 H    6.884300       1.516800     -0.5815000    
 H    6.534100     -0.1454000      -1.086100    
 H    5.779700       1.218700      -1.934700    


%chk=000060734-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060734

0 1
O -2.395452 -2.212160 -0.323843
O -4.365952 -0.484513 0.705499
O 1.758348 0.336847 -0.617899
O 0.482229 -2.095142 0.240104
O 2.769408 0.184371 1.489847
N -1.738574 1.486429 -0.122450
C -2.416610 0.265222 -0.607468
C -1.758251 -0.958463 0.070584
C -3.921970 0.503976 -0.304516
C -2.671679 2.614798 -0.297861
C -0.345960 1.580851 -0.576472
C -0.275633 -0.990723 -0.352092
C -4.003439 1.983039 0.183668
C 0.406046 0.360101 -0.003832
C 2.854438 0.145689 0.243236
C 4.111062 -0.108850 -0.569129
C 5.411003 0.144104 0.222647
C 6.664822 -0.219302 -0.599640
H -2.298335 0.137082 -1.714775
H -1.832194 -0.808911 1.170095
H -4.519779 0.356146 -1.225249
H -2.753817 2.952795 -1.361942
H -2.365741 3.482138 0.313154
H 0.113690 2.509074 -0.193865
H -0.251591 1.583328 -1.691654
H -0.215188 -1.155857 -1.444280
H -4.023012 1.981372 1.288096
H -4.893101 2.515559 -0.195060
H 0.513003 0.454381 1.091976
H -3.319420 -2.152906 0.045644
H -5.329765 -0.358243 0.889282
H 0.058364 -2.363409 1.093460
H 4.067764 -1.167027 -0.900000
H 4.070039 0.499050 -1.491550
H 5.453742 1.207477 0.527490
H 5.381326 -0.442868 1.158711
H 7.587639 -0.031887 -0.021249
H 6.657725 -1.288213 -0.885702
H 6.722917 0.376842 -1.530060


