%chk=000065268.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065268

0 1
 O    5.494100       1.438400     -0.2772000    
 O   -5.533000      -1.401300     -0.3696000    
 O    6.754000     -0.8035000      -1.121000    
 O   -6.725900      0.9219000      -1.062900    
 N    5.588400     -0.8707000     -0.3464000    
 N   -5.560600      0.9071000     -0.2850000    
 C  -3.9999999E-04 -4.7400001E-02  3.4000000E-03
 C    1.254500      4.1099999E-02  0.8744000    
 C   -1.267900     -9.9900000E-02  0.8581000    
 C    2.520400      0.1269000      1.7000001E-02
 C   -2.523900     -0.1551000     -1.2100000E-02
 C    3.793000      0.1854000      0.8606000    
 C   -3.787800     -0.2410000      0.8404000    
 C    5.043900      0.3336000      1.8900000E-02
 C   -5.048800     -0.3354000      1.5000000E-03
 H  -4.4799998E-02  0.8217000     -0.6642000    
 H   5.3599998E-02 -0.9403000     -0.6311000    
 H    1.311700     -0.8385000       1.526900    
 H    1.193200      0.9229000       1.523400    
 H   -1.232400     -0.9804000       1.511000    
 H   -1.311700      0.7829000       1.507500    
 H    2.570700     -0.7392000     -0.6548000    
 H    2.469900       1.014400     -0.6263000    
 H   -2.571800      0.7329000     -0.6543000    
 H   -2.476000      -1.022700     -0.6819000    
 H    3.752800       1.038400       1.548600    
 H    3.875300     -0.7151000       1.481200    
 H   -3.854900      0.6263000       1.508500    
 H   -3.753600      -1.129500       1.482500    
 H    5.304700      -1.786500     -1.7800000E-02
 H   -5.251000       1.792600      9.8700002E-02
 H    6.373900     -0.8907000      -2.011600    
 H   -6.341500       1.056500      -1.945700    


%chk=000065268-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065268

0 1
O 5.314499 0.959407 -0.956635
O -5.315399 -0.916398 -1.002071
O 7.298884 -0.777823 -0.738554
O -7.289639 0.821018 -0.704843
N 6.102477 -0.924187 0.047809
N -6.095580 0.919860 0.092423
C 0.001347 -0.007006 -0.121222
C 1.290461 -0.068921 0.728563
C -1.287355 0.020255 0.731003
C 2.572425 -0.077719 -0.131772
C -2.569572 0.066920 -0.127699
C 3.859447 -0.151781 0.727900
C -3.856323 0.105297 0.734622
C 5.112937 0.012635 -0.113861
C -5.110350 -0.012651 -0.113994
H 0.033275 0.893407 -0.768770
H -0.030926 -0.880216 -0.804967
H 1.262896 -0.974984 1.369929
H 1.317549 0.801244 1.417733
H -1.314967 -0.877950 1.383207
H -1.258694 0.898656 1.409699
H 2.547162 -0.936382 -0.831897
H 2.622188 0.836200 -0.752828
H -2.543585 0.954891 -0.790317
H -2.620278 -0.819184 -0.787747
H 3.844224 0.671714 1.469206
H 3.890642 -1.101691 1.297770
H -3.883017 1.026850 1.349548
H -3.845228 -0.752841 1.435586
H 6.129284 -1.748148 0.644575
H -6.117782 1.715560 0.726610
H 7.070029 0.065103 -1.255113
H -7.062929 0.004668 -1.263194


