%chk=000038945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038945

0 1
 O   -1.590100      0.2161000       1.525100    
 N  -0.5961000      3.1500001E-02 -0.5933000    
 N   -3.916600      0.9412000      0.3790000    
 C   0.7864000     -1.0000000E-03 -0.2930000    
 C    1.404300      -1.220500     -5.9000000E-02
 C    1.500000       1.187000     -0.2377000    
 C   -2.999500      0.1392000     -0.4273000    
 C   -1.657700      0.1400000      0.3015000    
 C    2.767000      -1.252500      0.2369000    
 C    2.862700       1.154900      5.7999998E-02
 C   0.6506000      -2.509700     -0.1146000    
 C   0.8498000       2.509300     -0.4868000    
 C    3.496300     -6.4900003E-02  0.2953000    
 C   -3.557100      -1.270600     -0.5842000    
 H   -2.892100      0.6077000      -1.412100    
 H  -0.8152000     -0.1573000      -1.568900    
 H    3.276600      -2.193800      0.4253000    
 H    3.446000       2.070500      0.1087000    
 H  -9.8899998E-02  -2.548400      0.6827000    
 H   0.1538000      -2.624400      -1.083900    
 H    1.311200      -3.374300      1.2800000E-02
 H    1.578400       3.327300     -0.4930000    
 H   0.3507000       2.516000      -1.461500    
 H   0.1168000       2.727400      0.2967000    
 H    4.557300     -8.9900002E-02  0.5261000    
 H   -3.674400      -1.766500      0.3864000    
 H   -4.531100      -1.259600      -1.084800    
 H   -2.877200      -1.887600      -1.182100    
 H   -4.833900      0.9639000     -6.5300003E-02
 H   -3.592200       1.907400      0.4074000    


%chk=000038945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038945

0 1
O -1.548939 1.136554 1.052854
N -0.591465 -0.066873 -0.718134
N -3.939298 1.277661 -0.285426
C 0.794498 -0.047504 -0.321039
C 1.468329 -1.301397 -0.217576
C 1.472357 1.185593 -0.095674
C -3.049518 0.167435 -0.640605
C -1.663858 0.475422 -0.021267
C 2.837349 -1.308354 0.135868
C 2.840665 1.129617 0.273133
C 0.729244 -2.605203 -0.467051
C 0.784934 2.523738 -0.265049
C 3.521345 -0.099688 0.390898
C -3.534096 -1.225922 -0.128129
H -2.939527 0.110763 -1.745015
H -0.828289 -0.649297 -1.525997
H 3.362378 -2.266706 0.223034
H 3.374926 2.069473 0.454468
H -0.195221 -2.666768 0.137271
H 0.435178 -2.726103 -1.529888
H 1.364216 -3.468937 -0.208678
H 1.524394 3.339763 -0.330730
H 0.158845 2.543929 -1.176300
H 0.106373 2.721305 0.584372
H 4.579961 -0.116509 0.672579
H -3.581403 -1.227153 0.975500
H -4.545289 -1.438048 -0.522295
H -2.866411 -2.047673 -0.453439
H -4.937872 1.065952 -0.344161
H -3.658007 1.733328 0.590877


