%chk=000043174.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043174

0 1
 O   -1.068300      -2.062200     -5.7200000E-02
 O   -1.931500       1.814700     -0.4432000    
 N   -2.621100     -0.1022000      0.6642000    
 N   -6.175300      6.4199999E-02 -0.3736000    
 C    2.097800      0.6530000      1.4700000E-02
 C    2.351900     -0.7381000     -4.4599999E-02
 C  -0.2930000      0.2037000      2.4300000E-02
 C   0.7694000       1.107500      4.8599999E-02
 C  -4.3099999E-02  -1.164100     -3.4000002E-02
 C    1.270200      -1.633500     -6.8400003E-02
 C   -1.657100      0.7129000      6.1799999E-02
 C   -4.019000      0.2522000      0.7582000    
 C    3.179500       1.548400      3.8500000E-02
 C    3.680300      -1.192600     -7.8599997E-02
 C   -4.776100     -0.2539000     -0.4608000    
 C    4.492900       1.079000      4.1000000E-03
 C    4.742800     -0.2888000     -5.4200001E-02
 H   0.5726000       2.177300      9.9799998E-02
 H    1.457700      -2.705000     -0.1138000    
 H   -4.107200       1.340600      0.8504000    
 H   -4.405400     -0.2026000       1.676800    
 H    3.008100       2.621800      8.3999999E-02
 H    3.899400      -2.257400     -0.1243000    
 H   -2.343400     -0.9871000       1.077300    
 H   -4.654500      -1.339200     -0.5551000    
 H   -4.359800      0.1848000      -1.374800    
 H    5.320500       1.782000      2.3100000E-02
 H    5.765500     -0.6535000     -8.0899999E-02
 H  -0.7028000      -2.962600     -9.6600004E-02
 H   -6.300000       1.072100     -0.2860000    
 H   -6.574000     -0.3405000      0.4727000    


%chk=000043174-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043174

0 1
O -0.900287 -2.369506 0.462734
O -1.926901 1.782460 0.370118
N -2.709603 -0.391802 0.622238
N -6.238335 0.566595 -0.557506
C 2.101198 0.610525 -0.008522
C 2.478930 -0.788019 0.017593
C -0.287198 -0.005903 0.285974
C 0.722259 0.952969 0.127663
C 0.112723 -1.390901 0.305851
C 1.450559 -1.769421 0.176666
C -1.699603 0.527405 0.423926
C -4.110072 0.033483 0.740695
C 3.121181 1.606534 -0.168404
C 3.862895 -1.137913 -0.116296
C -4.846589 0.102573 -0.636568
C 4.462252 1.238704 -0.296648
C 4.833596 -0.144544 -0.269894
H 0.401359 2.001099 0.112751
H 1.727990 -2.832546 0.196540
H -4.124681 1.038896 1.198064
H -4.642942 -0.667314 1.412466
H 2.829465 2.663012 -0.187860
H 4.152466 -2.195420 -0.096740
H -2.459236 -1.386989 0.630526
H -4.829201 -0.896279 -1.113402
H -4.280111 0.784744 -1.295377
H 5.235859 2.004349 -0.418036
H 5.888953 -0.421087 -0.371491
H -0.519906 -3.281220 0.452996
H -6.350603 1.548905 -0.293434
H -6.879417 -0.052489 -0.054224


