%chk=000152507.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152507

0 1
 O    4.571000       1.405000      0.3344000    
 O   -5.068800      -1.376200     -0.1985000    
 N   3.6300000E-02 -0.1347000      0.6122000    
 N  -0.5198000      0.1491000     -0.4748000    
 N    5.468700      -1.199900     -0.2347000    
 C    3.677700      0.3782000      0.2612000    
 C    4.101400     -0.9207000     -1.9900000E-02
 C    1.400300     -0.3983000      0.3997000    
 C    2.323800      0.6401000      0.4713000    
 C    3.171200      -1.957700     -9.0599999E-02
 C    1.817300      -1.695900      0.1198000    
 C   -1.877000      0.4112000     -0.2639000    
 C   -4.161100     -0.3645000     -0.1273000    
 C   -2.806800     -0.6259000     -0.3361000    
 C   -2.301300       1.710000      1.6899999E-02
 C   -4.585400      0.9342000      0.1535000    
 C   -3.655500       1.971400      0.2253000    
 C    4.844700       2.112500     -0.8730000    
 C   -6.436900      -1.038000      2.4400000E-02
 H    1.994700       1.652800      0.6917000    
 H    3.488100      -2.974400     -0.3086000    
 H    1.099300      -2.509700      6.3800000E-02
 H   -2.480100      -1.639600     -0.5560000    
 H   -1.584500       2.525100      7.4199997E-02
 H   -5.620700       1.207700      0.3259000    
 H   -3.984800       2.983200      0.4436000    
 H    5.767800      -2.144900     -0.4353000    
 H    6.151300     -0.4566000     -0.1700000    
 H    5.600100       2.873700     -0.6601000    
 H    3.940100       2.610000      -1.237000    
 H    5.235500       1.437500      -1.640900    
 H   -6.809900     -0.3463000     -0.7385000    
 H   -6.598100     -0.6618000       1.040400    
 H   -7.017500      -1.961400     -7.0200004E-02


%chk=000152507-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152507

0 1
O 5.125989 1.119633 -0.304215
O -5.383901 -1.408958 0.122461
N 0.288080 0.347529 -0.108276
N -0.694009 -0.524475 -0.050543
N 5.627551 -1.491269 -0.241683
C 3.984537 0.291813 -0.238116
C 4.297600 -1.108888 -0.206454
C 1.590542 -0.216389 -0.137897
C 2.656699 0.730103 -0.203926
C 3.222762 -2.042016 -0.140486
C 1.890063 -1.608713 -0.106773
C -2.000947 0.065289 -0.020486
C -4.405664 -0.400547 0.068785
C -3.068824 -0.860733 0.035083
C -2.269475 1.467257 -0.042056
C -4.684252 0.988750 0.047692
C -3.602671 1.906021 -0.007655
C 4.899880 2.564453 -0.345463
C -6.784293 -0.986111 0.158593
H 2.389239 1.790534 -0.225764
H 3.455234 -3.113660 -0.116448
H 1.060490 -2.319715 -0.056396
H -2.855635 -1.933188 0.051461
H -1.429558 2.165580 -0.084857
H -5.711620 1.363976 0.073062
H -3.822389 2.979995 -0.023536
H 5.894691 -2.470624 -0.220192
H 6.343264 -0.769608 -0.288357
H 5.900910 3.017373 -0.398423
H 4.378401 2.911440 0.567368
H 4.310891 2.849105 -1.238644
H -7.057752 -0.414931 -0.750452
H -6.999048 -0.374788 1.057216
H -7.365685 -1.919041 0.198278


