%chk=000055723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055723

0 1
 N   -4.215700       1.337300     -2.5699999E-02
 N   0.1786000     -0.9430000      1.5600000E-02
 N  -0.1312000      0.3820000     -7.0000002E-03
 N  -3.7000000E-02  -3.129800      5.3199999E-02
 N    1.309400      -2.819200      4.8700001E-02
 N    6.230700       1.437100     -1.7800000E-02
 C   -4.444100       2.104600      -1.247800    
 C   -4.447300       2.145200       1.169300    
 C   -5.132400       3.376000     -0.7565000    
 C   -4.547200       3.570900      0.6315000    
 C   -3.828200      1.4900000E-02 -2.9000000E-03
 C   -2.490500     -0.3682000      4.1999999E-03
 C   -2.121600      -1.720000      2.7100001E-02
 C   -4.810600     -0.9754000      1.3200000E-02
 C  -0.7042000      -1.996900      3.2600001E-02
 C   -1.409400      0.6430000     -1.2100000E-02
 C   -3.106400      -2.704700      4.3000001E-02
 C   -4.452000      -2.327800      3.5999998E-02
 C    1.418800      -1.509200      2.6200000E-02
 C    2.649700     -0.7567000      1.4700000E-02
 C    3.246100     -0.4138000      -1.198400    
 C    3.242200     -0.3711000       1.217100    
 C    5.028100      0.7008000     -7.1000000E-03
 C    4.435400      0.3149000      -1.209400    
 C    4.431500      0.3578000       1.206300    
 C    6.522000       2.382900       1.041500    
 C    7.185400       1.268300      -1.095300    
 H   -5.077000       1.566300      -1.961000    
 H   -3.488200       2.340400      -1.728300    
 H   -3.633300       2.054700       1.896000    
 H   -5.386000       1.842400       1.646300    
 H   -6.214700       3.213100     -0.6855000    
 H   -4.956900       4.229000      -1.417600    
 H   -3.546800       4.013800      0.5555000    
 H   -5.160300       4.215900       1.266800    
 H   -5.865200     -0.7094000      8.1000002E-03
 H   -1.687800       1.708400     -2.7899999E-02
 H   -2.846700      -3.759400      6.0800001E-02
 H   -5.225900      -3.090400      4.8300002E-02
 H    2.794500     -0.7048000      -2.144000    
 H    2.790200     -0.6331000       2.170900    
 H    4.867500      0.5761000      -2.171200    
 H    4.873300      0.6324000       2.160000    
 H    5.636500       2.970600       1.309100    
 H    7.292600       3.097900      0.7322000    
 H    6.892000       1.865400       1.932800    
 H    6.877100       1.836200      -1.979400    
 H    7.300400      0.2131000      -1.368200    
 H    8.178500       1.627400     -0.8027000    


%chk=000055723-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055723

0 1
N -4.375065 1.412558 0.062062
N 0.190123 -0.719402 -0.385390
N -0.182923 0.620994 -0.263403
N 0.008798 -2.950395 -0.726582
N 1.376516 -2.607645 -0.607223
N 6.587975 1.311590 0.157023
C -5.767081 1.842491 -0.214317
C -4.017666 2.023137 1.378655
C -5.811247 3.313733 0.283164
C -4.608147 3.449369 1.276691
C -3.941567 0.119879 -0.305069
C -2.532276 -0.196757 -0.350996
C -2.117781 -1.549899 -0.616061
C -4.863231 -0.893634 -0.677030
C -0.699624 -1.803928 -0.588229
C -1.503045 0.819418 -0.240137
C -3.065895 -2.558119 -0.922903
C -4.424672 -2.206237 -0.983273
C 1.486785 -1.255681 -0.407228
C 2.757066 -0.552004 -0.253421
C 3.959099 -1.317000 -0.301912
C 2.870898 0.854131 -0.062942
C 5.337094 0.702600 0.023867
C 5.215416 -0.713641 -0.167897
C 4.127324 1.466741 0.072752
C 6.681479 2.765144 0.338124
C 7.811735 0.501953 0.103443
H -6.504394 1.227789 0.354041
H -5.993489 1.738720 -1.289405
H -2.934111 2.011981 1.565931
H -4.506437 1.453726 2.202513
H -6.777250 3.534212 0.768741
H -5.693921 4.013953 -0.560565
H -3.854219 4.145759 0.871604
H -4.918418 3.825988 2.266122
H -5.934551 -0.675544 -0.693550
H -1.784971 1.874785 -0.197055
H -2.719290 -3.574928 -1.124495
H -5.169869 -2.965683 -1.245104
H 3.879599 -2.398773 -0.449417
H 1.965546 1.464783 -0.025812
H 6.107808 -1.344000 -0.213754
H 4.165619 2.550177 0.216801
H 6.233746 3.315593 -0.514554
H 7.740470 3.058804 0.411688
H 6.169743 3.098733 1.264110
H 7.917996 -0.022246 -0.868267
H 7.835054 -0.262302 0.906649
H 8.689151 1.154974 0.233208


