%chk=000135354.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135354

0 1
 O    4.336500       2.205000     -5.0000002E-04
 N   0.1584000      -2.217300       0.000000    
 N  -0.3185000     -8.4700003E-02  1.0000000E-03
 N   -1.183200      -2.202400     -6.9999998E-04
 C   -2.749700     -0.3442000     -3.0000001E-04
 C    2.077200     -0.6750000      7.9999998E-04
 C   0.6645000     -0.9548000      6.9999998E-04
 C   -1.421200     -0.8896000     -3.0000001E-04
 C   -2.936500       1.038200      1.9999999E-04
 C   -4.227100       1.567600      3.0000001E-04
 C   -3.853500      -1.197100     -6.9999998E-04
 C    2.529000      0.6460000      6.0000003E-04
 C    2.998200      -1.724100      3.9999999E-04
 C   -5.330700      0.7145000     -3.0000001E-04
 C    3.897500      0.9167000      1.9999999E-04
 C   -5.143900     -0.6678000     -6.0000003E-04
 C    4.366400      -1.453500       0.000000    
 C    4.816100     -0.1330000       0.000000    
 C   -4.427900       3.045600      6.9999998E-04
 C    5.748500       2.409900     -1.3000000E-03
 H   -2.088600       1.719700      2.4999999E-03
 H    1.827700       1.477600      5.0000002E-04
 H   -3.747100      -2.278900     -1.0000000E-03
 H   0.6282000      -3.114600     -3.9999999E-04
 H    2.697300      -2.767500      3.9999999E-04
 H   -6.341400       1.113900      1.6000000E-03
 H   -6.003600      -1.331600     -5.0000002E-04
 H    5.081400      -2.271200     -3.0000001E-04
 H    5.891800      5.5000000E-03 -3.0000001E-04
 H   -3.656600       3.546100     -0.5946000    
 H   -5.395200       3.316600     -0.4359000    
 H   -4.388100       3.429700       1.024800    
 H    6.212200       2.013300     -0.9109000    
 H    6.213100       2.014000      0.9081000    
 H    5.918100       3.491600     -1.9000000E-03


%chk=000135354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135354

0 1
O 4.240541 2.216251 -0.009173
N 0.151152 -2.381260 0.005740
N -0.287517 -0.198617 -0.001489
N -1.237618 -2.316124 0.004174
C -2.809237 -0.370697 -0.003023
C 2.158722 -0.825638 0.002605
C 0.718336 -1.112033 0.002193
C -1.460964 -0.959043 -0.000447
C -2.958634 1.039667 -0.009225
C -4.240863 1.640696 -0.011651
C -3.962750 -1.199771 -0.003485
C 2.571915 0.526262 -0.002933
C 3.135533 -1.863011 0.008279
C -5.383175 0.798186 -0.015940
C 3.948935 0.848468 -0.003062
C -5.242570 -0.610096 -0.010398
C 4.503156 -1.529038 0.008273
C 4.927499 -0.179660 0.002607
C -4.386458 3.153673 0.013709
C 5.647237 2.612695 -0.010142
H -2.054062 1.658297 -0.012009
H 1.824173 1.324121 -0.007269
H -3.842623 -2.288000 -0.002040
H 0.600548 -3.293858 0.009070
H 2.843997 -2.919838 0.012800
H -6.384548 1.246631 -0.024269
H -6.134455 -1.247212 -0.015454
H 5.255422 -2.325556 0.012720
H 5.996691 0.053343 0.002671
H -3.583269 3.646308 -0.562970
H -5.356750 3.473997 -0.405946
H -4.329907 3.540893 1.049905
H 6.172450 2.241377 -0.912545
H 6.171267 2.250059 0.896463
H 5.637127 3.712728 -0.015438


