%chk=000113349.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113349

0 1
 O   0.8955000      -4.146000      0.1167000    
 N  -0.2263000     -0.6501000     -1.5000000E-02
 N   -4.752500       1.092900      0.1550000    
 C   2.8000001E-02  -1.992500     -0.4989000    
 C   -1.556700     -0.3054000      0.4452000    
 C   0.8047000      0.3125000     -4.6999999E-03
 C   0.6838000      -2.822500      0.5916000    
 C   -2.332200      0.4351000     -0.6392000    
 C   0.5466000       1.605400      0.4503000    
 C    2.082200     -2.8600000E-02 -0.4487000    
 C    1.566100       2.557300      0.4616000    
 C    3.101800      0.9233000     -0.4374000    
 C    2.843700       2.216400      1.7800000E-02
 C   -3.684700      0.8023000     -0.1942000    
 H   0.5998000      -2.010100      -1.434700    
 H  -0.9176000      -2.478100     -0.7775000    
 H   -1.536900      0.2478000       1.392700    
 H   -2.105100      -1.224400      0.6967000    
 H   3.6400001E-02  -2.884000       1.473000    
 H    1.645900      -2.421600      0.9221000    
 H   -1.810000       1.340600     -0.9644000    
 H   -2.410100     -0.2017000      -1.529500    
 H  -0.4211000       1.933500      0.8128000    
 H    2.347300      -1.013400     -0.8167000    
 H    1.366400       3.564200      0.8169000    
 H    4.096800      0.6589000     -0.7834000    
 H    3.637500       2.957500      2.6699999E-02
 H    1.492000      -4.089400     -0.6493000    


%chk=000113349-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113349

0 1
O 0.696911 -4.321579 0.020623
N -0.186679 -0.620790 0.020290
N -4.839355 0.986897 0.233257
C 0.036088 -1.978403 -0.506210
C -1.538920 -0.299008 0.479601
C 0.835906 0.353877 0.015221
C 0.609694 -2.954252 0.552906
C -2.394249 0.393324 -0.640427
C 0.581125 1.701302 0.422379
C 2.166454 0.030197 -0.396200
C 1.608620 2.666760 0.415469
C 3.180525 1.009009 -0.406332
C 2.917997 2.337658 -0.001637
C -3.748243 0.730267 -0.177501
H 0.703776 -1.942396 -1.389697
H -0.925400 -2.393467 -0.861609
H -1.506727 0.350941 1.372017
H -2.046866 -1.230372 0.785281
H -0.080112 -3.031225 1.409406
H 1.589598 -2.594884 0.927763
H -1.883028 1.312653 -0.980136
H -2.466169 -0.281014 -1.514396
H -0.416126 2.009217 0.751139
H 2.423338 -0.988707 -0.700453
H 1.376335 3.688763 0.736534
H 4.189392 0.724124 -0.727029
H 3.710435 3.092570 -0.008402
H 1.426979 -4.371564 -0.646356


