%chk=000133060.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133060

0 1
 O   -1.785000      0.7211000      0.1234000    
 O    6.443500      0.9127000     -0.1385000    
 N   -5.151300      -1.489800      0.2784000    
 N   -3.032500       1.361000      0.1304000    
 C   -5.424700      0.7333000      0.2075000    
 C   -5.829700     -0.4343000       1.094000    
 C   -5.934700      0.2767000      -1.155500    
 C   -5.749600      -1.249100      -1.070600    
 C   -3.733000      -1.021200      0.2549000    
 C   -3.951900      0.4630000      0.1959000    
 C  -0.7761000       1.717300      5.1100001E-02
 C   0.5422000       1.084600      4.1800000E-02
 C    2.918000     -4.7200002E-02  2.4400000E-02
 C    1.626400      0.5675000      3.4000002E-02
 C    4.064100      0.7427000     -5.4099999E-02
 C    5.323600      0.1431000     -6.2700003E-02
 C    3.028500      -1.435300      9.4300002E-02
 C    5.435400      -1.245700      7.4000000E-03
 C    4.287900      -2.034800      8.5800000E-02
 C    7.698700      0.2344000     -0.1417000    
 H   -5.705800       1.734000      0.5313000    
 H   -5.425200     -0.3884000       2.112700    
 H   -6.913200     -0.5921000       1.149600    
 H   -5.361500      0.7071000      -1.983500    
 H   -6.993600      0.5266000      -1.282400    
 H   -6.720600      -1.754300      -1.135000    
 H   -5.123100      -1.642000      -1.879000    
 H   -3.177400      -1.402000     -0.6064000    
 H   -3.224300      -1.295300       1.184300    
 H  -0.8638000       2.386400      0.9149000    
 H  -0.9139000       2.308200     -0.8618000    
 H    3.986600       1.826400     -0.1087000    
 H    2.143300      -2.063700      0.1560000    
 H    6.381200      -1.776500      5.2999998E-03
 H    4.374000      -3.116200      0.1403000    
 H    7.806900     -0.4079000      -1.022300    
 H    7.863400     -0.3119000      0.7932000    
 H    8.479400      0.9995000     -0.2065000    


%chk=000133060-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133060

0 1
O -1.740084 0.625607 0.057920
O 6.562595 0.970143 -0.027308
N -5.389045 -1.519647 0.354761
N -3.057653 1.328292 0.068101
C -5.488840 0.789840 0.216530
C -5.991664 -0.373034 1.142799
C -6.081300 0.320126 -1.155016
C -5.979350 -1.253724 -1.020217
C -3.937760 -1.090617 0.307444
C -4.007338 0.442912 0.182181
C -0.706355 1.689171 -0.051463
C 0.611686 1.053105 -0.048080
C 3.025718 -0.092677 -0.037260
C 1.730894 0.529017 -0.043931
C 4.201892 0.699252 -0.035444
C 5.474836 0.082619 -0.028049
C 3.138913 -1.516286 -0.031306
C 5.591516 -1.329856 -0.021596
C 4.412575 -2.113101 -0.023119
C 7.908358 0.392879 -0.016462
H -5.723871 1.824665 0.499158
H -5.583034 -0.343862 2.165965
H -7.090539 -0.457290 1.179470
H -5.511759 0.718738 -2.010504
H -7.130708 0.652775 -1.250760
H -6.973837 -1.728208 -1.066635
H -5.340398 -1.713727 -1.791767
H -3.396237 -1.566095 -0.527137
H -3.429984 -1.382010 1.244852
H -0.814894 2.387159 0.802148
H -0.873868 2.259395 -0.986745
H 4.143232 1.791345 -0.039308
H 2.231757 -2.127695 -0.032279
H 6.569333 -1.819831 -0.015412
H 4.498403 -3.205387 -0.017897
H 8.090043 -0.225256 -0.917410
H 8.079024 -0.216853 0.892326
H 8.589944 1.256019 -0.016349


