%chk=000020005.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020005

1 1
 O   4.7100000E-02  0.1100000      8.5500002E-02
 O   -2.805100      -2.052400     -6.7000002E-02
 N    3.777000      9.9999998E-03  0.1499000    
 N   -2.235500      0.2126000     -0.3624000    
 C    2.363400      4.8700001E-02  0.7123000    
 C    1.369000      3.7400000E-02 -0.4319000    
 C   -2.797200       1.492600     -1.2000001E-03
 C   -4.261300       1.173900      0.2260000    
 C    3.994300       1.210600     -0.7599000    
 C    4.779400      5.2700002E-02   1.294300    
 C    3.971100      -1.271900     -0.6470000    
 C   -4.250200     -0.2697000      0.7144000    
 C  -0.9197000      0.1021000     -0.9537000    
 C   -3.032100     -0.8566000      4.0500000E-02
 H    2.227100     -0.8174000       1.371000    
 H    2.258500      0.9548000       1.321300    
 H    1.497500      0.8965000      -1.095400    
 H    1.437800     -0.8825000      -1.019200    
 H   -2.654400       2.221500     -0.8038000    
 H   -2.306900       1.840400      0.9138000    
 H   -4.805300       1.231600     -0.7252000    
 H   -4.741900       1.859300      0.9296000    
 H    3.661200       2.113200     -0.2391000    
 H    5.065800       1.280500     -0.9744000    
 H    3.463500       1.072500      -1.704900    
 H    4.604600     -0.8143000       1.938300    
 H    5.790200      1.9500000E-02  0.8769000    
 H    4.627500      0.9818000       1.851500    
 H    3.647300      -2.119000     -3.5300002E-02
 H    3.414700      -1.222600      -1.586000    
 H    5.037000      -1.366300     -0.8790000    
 H   -5.156900     -0.8051000      0.4226000    
 H   -4.112700     -0.3243000       1.798900    
 H  -0.7681000      0.9369000      -1.646300    
 H  -0.8617000     -0.8482000      -1.495400    


%chk=000020005-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020005

1 1
O 0.192665 1.868027 -1.328741
O -0.345178 -1.201765 0.119252
N 3.118321 -0.154175 0.131083
N -1.746692 0.589595 -0.477392
C 1.944321 0.852555 0.028294
C 1.499155 1.208936 -1.407900
C -2.941612 1.312081 0.042443
C -3.610180 0.259190 0.971961
C 4.387713 0.427150 -0.480338
C 3.350846 -0.431807 1.617130
C 2.757338 -1.479939 -0.553603
C -2.448651 -0.679537 1.394393
C -0.986373 1.016307 -1.636895
C -1.398614 -0.508190 0.298117
H 1.099607 0.368478 0.540680
H 2.254902 1.759490 0.575094
H 2.175392 1.942847 -1.879287
H 1.438285 0.307248 -2.047565
H -3.597771 1.621657 -0.788662
H -2.626724 2.218068 0.593598
H -4.369958 -0.308868 0.409278
H -4.109384 0.733150 1.831050
H 4.653599 1.353359 0.052125
H 5.202032 -0.307587 -0.383545
H 4.214085 0.644465 -1.544234
H 2.456161 -0.926153 2.024619
H 4.226723 -1.089241 1.729456
H 3.527587 0.520496 2.140243
H 1.722116 -1.741727 -0.282178
H 2.844056 -1.363980 -1.643678
H 3.466568 -2.250190 -0.213591
H -2.739776 -1.738444 1.484290
H -2.001056 -0.384139 2.362855
H -1.632387 1.650413 -2.263478
H -0.652117 0.121032 -2.195175


