%chk=000162346.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162346

1 1
 N    2.602900      0.3654000      -1.100100    
 N  -0.1371000     -0.9946000      2.2200000E-02
 N   -1.234200      -1.770400     -0.2093000    
 C    3.167700     -0.9574000      0.7617000    
 C    4.221500      7.8100003E-02  0.4994000    
 C    2.177500     -0.6296000     -0.3785000    
 C    3.840000      0.8298000     -0.6074000    
 C    2.505000     -0.7601000       2.125800    
 C    3.724000      -2.374200      0.6088000    
 C    5.407200      0.3444000       1.164100    
 C    4.620300       1.868300      -1.089900    
 C   0.9283000      -1.400000     -0.5740000    
 C    1.986500       1.012900      -2.266400    
 C    6.208300       1.387400      0.6934000    
 C    5.817700       2.143100     -0.4245000    
 C   -2.505900      -1.161300     -0.1892000    
 C   -2.647700      0.1415000      0.2904000    
 C   -1.105600      -3.217400     -6.3600004E-02
 C   -3.907100      0.7626000      0.3170000    
 C   -3.619500      -1.859300     -0.6475000    
 C   -5.039000      5.2400000E-02 -0.1493000    
 C   -4.878200      -1.257900     -0.6284000    
 C   -4.067900       2.072800      0.7960000    
 C   -6.298400      0.6734000     -0.1226000    
 C   -5.326500       2.674200      0.8152000    
 C   -6.439800       1.976000      0.3567000    
 H    3.228600     -0.8672000       2.941800    
 H    2.052300      0.2349000       2.213400    
 H    1.708400      -1.494500       2.289400    
 H    2.934500      -3.123400      0.7364000    
 H    4.159800      -2.530400     -0.3853000    
 H    4.504700      -2.580900       1.349500    
 H    5.711900     -0.2366000       2.027600    
 H    4.333600       2.461400      -1.951200    
 H    1.015600      -2.267200      -1.250300    
 H    2.660200      0.9176000      -3.122600    
 H    1.796700       2.063700      -2.030100    
 H    1.039100      0.5187000      -2.497100    
 H    7.143600       1.617900       1.196300    
 H    6.455400       2.950400     -0.7746000    
 H   -1.787800      0.6981000      0.6586000    
 H  -0.1256000      -3.520000      0.3227000    
 H   -1.255500      -3.711300      -1.029500    
 H   -1.839600      -3.608800      0.6508000    
 H   -3.540900      -2.869500      -1.039600    
 H   -5.734100      -1.821200     -0.9944000    
 H   -3.212100       2.638000       1.159400    
 H   -7.182200      0.1464000     -0.4760000    
 H   -5.437100       3.688300       1.188300    
 H   -7.419300       2.445000      0.3719000    


%chk=000162346-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162346

1 1
N 2.301688 0.584565 -0.228285
N -0.247241 -0.986728 0.038484
N -1.337542 -1.760088 0.112596
C 3.530761 -1.246613 0.662871
C 4.449189 -0.065081 0.360814
C 2.155329 -0.687571 0.239395
C 3.678741 0.998185 -0.162652
C 3.539758 -1.604183 2.180999
C 3.908924 -2.495437 -0.192771
C 5.833824 0.093024 0.520494
C 4.232013 2.235095 -0.537968
C 0.973017 -1.475055 0.350198
C 1.266570 1.492576 -0.761101
C 6.420795 1.329904 0.147606
C 5.629901 2.384289 -0.373097
C -2.606032 -1.124357 -0.155868
C -2.786631 0.228134 0.163533
C -1.274905 -3.185384 0.523721
C -4.031305 0.874801 -0.104810
C -3.664624 -1.883705 -0.757566
C -5.108235 0.114707 -0.711444
C -4.883945 -1.266576 -1.026003
C -4.250205 2.255286 0.222208
C -6.356888 0.762916 -0.975646
C -5.479230 2.860106 -0.046819
C -6.539287 2.110092 -0.651235
H 4.552450 -1.931578 2.472952
H 3.267271 -0.734938 2.803498
H 2.840773 -2.430157 2.402054
H 3.222542 -3.338325 0.002870
H 3.891397 -2.267719 -1.272189
H 4.928584 -2.823728 0.072495
H 6.457270 -0.712321 0.922910
H 3.626735 3.054498 -0.936026
H 1.132025 -2.503249 0.699584
H 1.603872 1.892996 -1.732103
H 1.114752 2.333605 -0.060908
H 0.324487 0.944913 -0.881954
H 7.499370 1.474159 0.264173
H 6.105713 3.329732 -0.651488
H -1.975425 0.786401 0.641471
H -0.785856 -3.266868 1.512454
H -0.709523 -3.784658 -0.213151
H -2.293420 -3.580672 0.617056
H -3.509927 -2.927126 -1.049004
H -5.687823 -1.839905 -1.500517
H -3.441280 2.829460 0.688549
H -7.170085 0.189402 -1.434388
H -5.641218 3.913109 0.204977
H -7.496923 2.599570 -0.855568


