%chk=000208930.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208930

0 1
N -3.875794 0.000972 -0.298236
N 1.114007 -0.000410 -1.307567
C -0.854632 0.676106 0.649871
C -0.854985 -0.675610 0.649969
C -2.146012 1.447062 0.770935
C -2.146772 -1.445874 0.771138
C -3.049697 1.243161 -0.460391
C -3.050345 -1.241670 -0.460219
C 0.368000 1.490854 0.492359
C 0.367223 -1.491020 0.492578
C 1.327473 1.194912 -0.509803
C 1.326850 -1.195727 -0.509628
C -4.996467 0.001197 -1.288769
C 0.582805 2.607047 1.314840
C 0.581451 -2.607200 1.315230
C 2.426915 2.046772 -0.708676
C 2.425849 -2.048188 -0.708374
C 1.746895 -0.000674 -2.653294
C 1.685145 3.443569 1.124090
C 1.683358 -3.444322 1.124605
C 2.595615 3.172193 0.100305
C 2.593966 -3.173574 0.100778
H -2.690812 1.133073 1.688452
H -1.959416 2.531698 0.891578
H -1.960746 -2.530591 0.891935
H -2.691410 -1.131469 1.688609
H -3.740749 2.110187 -0.540646
H -2.430945 1.236707 -1.384220
H -2.431587 -1.235665 -1.384047
H -3.741848 -2.108346 -0.540359
H -5.629907 0.885455 -1.113804
H -5.630362 -0.882713 -1.113693
H -4.683769 0.001050 -2.342865
H -0.122714 2.824965 2.117285
H -0.124179 -2.824629 2.117711
H 3.160685 1.832119 -1.481996
H 3.159730 -1.834032 -1.481727
H 2.847676 -0.000965 -2.652995
H 1.396357 0.888582 -3.205461
H 1.395887 -0.889823 -3.205333
H 1.831611 4.305007 1.771715
H 1.829380 -4.305736 1.772362
H 3.447080 3.831116 -0.061656
H 3.445088 -3.832964 -0.061085


%chk=000208930-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208930

0 1
N -3.952659 0.000988 -0.281408
N 1.357896 -0.000461 -1.252400
C -0.822938 0.689303 0.610532
C -0.823300 -0.688819 0.610630
C -2.147276 1.438021 0.785018
C -2.148027 -1.436812 0.785244
C -3.153875 1.245427 -0.381757
C -3.154530 -1.243885 -0.381558
C 0.400709 1.526315 0.463357
C 0.399910 -1.526489 0.463575
C 1.425774 1.220313 -0.487851
C 1.425130 -1.221165 -0.487685
C -5.078129 0.001202 -1.238628
C 0.538765 2.723153 1.221385
C 0.537342 -2.723285 1.221783
C 2.494548 2.132379 -0.693384
C 2.493420 -2.133827 -0.693093
C 1.982401 -0.000720 -2.586730
C 1.615102 3.613882 1.033754
C 1.613209 -3.614608 1.034276
C 2.587819 3.326798 0.050945
C 2.586065 -3.328183 0.051413
H -2.666820 1.135790 1.716432
H -1.946947 2.520120 0.856717
H -1.948267 -2.519004 0.857120
H -2.667406 -1.134150 1.716608
H -3.873535 2.086589 -0.356526
H -2.600713 1.313013 -1.353913
H -2.601407 -1.311919 -1.353706
H -3.874628 -2.084668 -0.356189
H -5.705502 0.895982 -1.074546
H -5.705968 -0.893224 -1.074397
H -4.755518 0.001028 -2.311469
H -0.216280 2.958254 1.979799
H -0.217815 -2.957882 1.980242
H 3.265628 1.903347 -1.435211
H 3.264621 -1.905323 -1.434958
H 3.096314 -0.001056 -2.582314
H 1.647632 0.895551 -3.135784
H 1.647093 -0.896847 -3.135689
H 1.686518 4.524121 1.638479
H 1.684154 -4.524795 1.639134
H 3.419756 4.017134 -0.128152
H 3.417636 -4.018985 -0.127593


