%chk=000003043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003043

0 1
 O   -2.309600     -0.1204000     -0.7723000    
 O   -4.766600       1.193300      -1.225400    
 O    4.110800       1.647100      0.3427000    
 N  -5.4000001E-02 -7.6700002E-02 -4.9699999E-02
 N    1.798700      -1.584600     -0.5171000    
 N    1.162700       1.744600      0.4372000    
 N    3.976800     -0.5830000     -0.2838000    
 C   -1.230300     -0.9221000     -0.2595000    
 C   -1.726600      -1.610500       1.007700    
 C   -2.942800     -0.7993000       1.391100    
 C   -3.471400     -0.3685000      3.5399999E-02
 C   -4.337400      0.8746000      8.9000002E-02
 C    1.248700     -0.4157000     -0.1744000    
 C  -5.7799999E-02   1.247600      0.3246000    
 C    1.983200      0.6980000      0.1234000    
 C    3.435700      0.6594000      7.9300001E-02
 C    3.179900      -1.583700     -0.5482000    
 H  -0.9600000      -1.654300      -1.028400    
 H  -0.9824000      -1.673700       1.807400    
 H   -2.039400      -2.633400      0.7643000    
 H   -3.674400      -1.365700       1.973800    
 H   -2.629900      6.9200002E-02   1.983000    
 H   -4.018600      -1.188300     -0.4471000    
 H   -3.782400       1.736100      0.4743000    
 H   -5.221300      0.7156000      0.7135000    
 H  -0.9713000       1.797600      0.5056000    
 H    1.267000      -2.420100     -0.7375000    
 H   -3.971200       1.325400      -1.769200    
 H    3.596700      -2.562500     -0.8337000    


%chk=000003043-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003043

0 1
O -2.456535 -0.284297 -0.907816
O -4.821968 1.384467 -1.024250
O 4.099719 1.748659 0.478106
N -0.159303 -0.082385 -0.253398
N 1.820124 -1.627204 -0.397834
N 0.989813 1.843661 0.218094
N 3.955897 -0.558299 -0.009333
C -1.286129 -1.029793 -0.475987
C -1.699743 -1.781274 0.818831
C -2.802652 -0.868696 1.411892
C -3.533957 -0.368849 0.153373
C -4.189856 1.010575 0.238884
C 1.191071 -0.405645 -0.208625
C -0.220207 1.307795 0.014631
C 1.900656 0.778011 0.085513
C 3.367369 0.765164 0.210515
C 3.225896 -1.611444 -0.283238
H -0.984476 -1.712361 -1.294438
H -0.850384 -1.936805 1.503765
H -2.123754 -2.765352 0.547909
H -3.474072 -1.414086 2.094317
H -2.353424 -0.023101 1.965145
H -4.273797 -1.106845 -0.213208
H -3.438804 1.764182 0.560550
H -5.007777 0.990854 0.979200
H -1.161117 1.847693 -0.001176
H 1.325622 -2.491459 -0.625349
H -4.131089 1.358165 -1.735236
H 3.705677 -2.585329 -0.444840


