%chk=000012853.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012853

0 1
 O    3.570500       1.884500     -0.2221000    
 N   4.3499999E-02 -0.3018000      3.4100000E-02
 N   0.5724000      -1.536500      0.1693000    
 N    3.523600      0.6432000     -8.4500000E-02
 C   0.9954000      0.6788000     -7.8400001E-02
 C    2.211600      4.3900002E-02 -1.1800000E-02
 C   -1.328500     -0.1303000      1.9700000E-02
 C    1.889700      -1.318100      0.1405000    
 C   0.6551000       2.108200     -0.2361000    
 C   -1.888300       1.054700      0.4974000    
 C   -2.152800      -1.141800     -0.4733000    
 C    2.813100      -2.461200      0.2623000    
 C   -3.272200       1.228200      0.4822000    
 C   -3.536700     -0.9684000     -0.4886000    
 C   -4.096400      0.2167000     -1.0800000E-02
 H   0.5660000       2.611500      0.7313000    
 H    1.443800       2.638300     -0.7796000    
 H  -0.2244000       2.285900     -0.8611000    
 H   -1.331400       1.826200       1.011700    
 H   -1.747400      -2.072600     -0.8625000    
 H    3.448100      -2.538600     -0.6263000    
 H    3.460100      -2.341200       1.137400    
 H    2.276600      -3.409700      0.3721000    
 H   -3.711200       2.138300      0.8808000    
 H   -4.178800      -1.755300     -0.8733000    
 H   -5.174400      0.3491000     -1.6799999E-02


%chk=000012853-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012853

0 1
O 3.765048 1.773510 -0.199075
N 0.026874 -0.186475 0.050000
N 0.562325 -1.509618 0.187305
N 3.584581 0.488284 -0.090447
C 1.006605 0.774060 -0.082227
C 2.243618 0.057765 -0.003272
C -1.403341 -0.057760 0.039099
C 1.902969 -1.340670 0.157771
C 0.783797 2.230225 -0.351371
C -2.037406 1.068025 0.619516
C -2.172567 -1.101698 -0.530491
C 2.836961 -2.505204 0.290121
C -3.445707 1.161497 0.593793
C -3.578371 -0.998949 -0.543345
C -4.221087 0.133982 0.009923
H 0.826272 2.824291 0.581765
H 1.607328 2.602467 -0.980978
H -0.186896 2.416952 -0.840067
H -1.447883 1.843927 1.115613
H -1.660032 -1.975579 -0.939975
H 3.515623 -2.561819 -0.578838
H 3.474265 -2.396494 1.185359
H 2.265089 -3.443668 0.368036
H -3.935087 2.030858 1.045584
H -4.172540 -1.805374 -0.986066
H -5.313437 0.209464 -0.004131


