%chk=000053608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053608

0 1
 O    1.776900      -1.591100     -1.6600000E-02
 N    3.597500      0.4704000     -2.6600000E-02
 N    5.611600      2.8700000E-02  0.7425000    
 C   -4.437200      0.1840000      9.3999999E-03
 C   -2.909100      1.2800000E-02  2.0999999E-03
 C   -4.878700      0.9619000      -1.249100    
 C   -4.866300      0.9687000       1.268000    
 C   -5.215700      -1.151200      1.6899999E-02
 C   -2.127300       1.140900     -3.8000001E-03
 C   -2.396000      -1.260200      2.9000000E-03
 C  -0.1824000     -0.2921000     -9.1000004E-03
 C  -0.7411000      0.9858000     -9.7000003E-03
 C   -1.009800      -1.415100     -2.7999999E-03
 C    1.262900     -0.4539000     -1.5500000E-02
 C    2.168100      0.7862000     -2.2800000E-02
 C    4.362700      0.2968000      -1.129900    
 C    4.369800      0.3047000       1.073900    
 C    5.614100      2.2900000E-02 -0.6299000    
 H   -5.970000       1.060000      -1.289500    
 H   -4.467600       1.976900      -1.279100    
 H   -4.556800      0.4491000      -2.163200    
 H   -4.455200       1.983900       1.288400    
 H   -5.957100       1.066700       1.318800    
 H   -4.535000      0.4609000       2.181700    
 H   -6.297900     -0.9699000      2.1900000E-02
 H   -5.004700      -1.754600     -0.8738000    
 H   -4.995500      -1.749800      0.9086000    
 H   -2.540000       2.143900     -4.3000001E-03
 H   -2.990100      -2.165100      7.7999998E-03
 H  -0.1363000       1.887100     -1.4600000E-02
 H  -0.5982000      -2.421200     -2.2000000E-03
 H    1.983300       1.387500      0.8738000    
 H    1.976900       1.381500     -0.9220000    
 H    3.980900      0.3752000      -2.138300    
 H    3.991900      0.3910000       2.083600    
 H    6.516300     -0.1792000      -1.188500    


%chk=000053608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053608

0 1
O 1.854301 -1.626160 -0.128208
N 3.662562 0.510158 -0.022496
N 5.785575 0.303647 0.754978
C -4.539542 0.179297 0.015234
C -3.005646 -0.005741 -0.008446
C -4.970906 1.056194 -1.200188
C -4.947028 0.895642 1.339354
C -5.299320 -1.169657 -0.063004
C -2.154629 1.135226 0.033214
C -2.384297 -1.282619 -0.068371
C -0.142565 -0.271432 -0.046639
C -0.753903 1.012256 0.013976
C -0.983307 -1.414703 -0.087024
C 1.339657 -0.476547 -0.070740
C 2.232637 0.791746 -0.035456
C 4.428680 0.002766 -1.080970
C 4.527483 0.666282 1.063984
C 5.729110 -0.112724 -0.587232
H -6.067171 1.200659 -1.190114
H -4.498755 2.054549 -1.176393
H -4.694678 0.572162 -2.154660
H -4.462488 1.883452 1.438225
H -6.041640 1.051372 1.362890
H -4.664943 0.288771 2.218924
H -6.388059 -0.980996 -0.045755
H -5.071204 -1.717526 -0.995952
H -5.062398 -1.825532 0.794934
H -2.594924 2.137422 0.079867
H -2.997856 -2.187183 -0.100934
H -0.145930 1.923256 0.045812
H -0.509155 -2.401082 -0.132830
H 1.984301 1.379482 0.867835
H 1.978259 1.426107 -0.907194
H 3.991632 -0.246783 -2.043784
H 4.193755 1.042235 2.028983
H 6.617293 -0.469896 -1.102820


