%chk=000221774.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221774

0 1
N 0.791595 -1.002395 -0.206486
N -0.662396 0.766078 -0.454924
N 0.642619 1.281548 -0.484150
N 2.898533 0.276803 -0.346675
N -1.526525 -1.606835 -0.206890
C -0.624913 -0.680616 -0.219308
C 1.498320 0.258602 -0.344848
C 1.332588 -2.211565 0.364681
C -1.639785 1.643214 0.167317
C 2.264513 -2.153429 1.414422
C 0.920989 -3.442901 -0.173056
C 3.685027 1.452665 -0.586983
C -2.409354 1.231634 1.266194
C -1.820126 2.913616 -0.408855
C -2.927648 -1.432132 -0.376169
C 2.805127 -3.343850 1.905929
C 1.467826 -4.620764 0.339811
C 2.412570 -4.574922 1.370792
C -3.389093 2.093587 1.766971
C -2.796839 3.762226 0.113499
C 4.995499 1.245923 -1.069188
C 3.231735 2.746678 -0.284444
C -3.585031 3.354422 1.195852
C -3.483346 -0.600145 -1.366889
C -3.760756 -2.226584 0.438003
C 5.840829 2.342634 -1.237341
C 4.095728 3.828888 -0.465495
C 5.397017 3.635181 -0.938712
C -4.868545 -0.569100 -1.535882
C -5.142296 -2.178032 0.254249
C -5.699945 -1.351704 -0.728355
H 3.344053 -0.618280 -0.584775
H 2.554436 -1.199593 1.855221
H 0.167806 -3.473757 -0.964947
H -2.260232 0.257072 1.728478
H -1.197135 3.224254 -1.249252
H 3.531154 -3.309489 2.718055
H 1.152082 -5.581356 -0.067933
H 2.836286 -5.498433 1.761637
H -4.000655 1.776710 2.611493
H -2.945817 4.747533 -0.327161
H 5.352635 0.248012 -1.309830
H 2.218379 2.920036 0.084723
H -4.348871 4.019660 1.593406
H -2.838131 0.009348 -1.998193
H -3.319876 -2.875585 1.192855
H 6.854045 2.188041 -1.608071
H 3.745973 4.835308 -0.233157
H 6.060723 4.485469 -1.075938
H -5.302333 0.072440 -2.302145
H -5.790986 -2.789515 0.880095
H -6.778150 -1.320001 -0.864430


%chk=000221774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221774

0 1
N 0.765528 -0.820442 0.185242
N -0.659014 0.886133 0.077684
N 0.649878 1.433338 -0.159979
N 2.830570 0.360612 -0.262878
N -1.526806 -1.463250 0.386372
C -0.643230 -0.522901 0.226909
C 1.463289 0.373585 -0.075392
C 1.334054 -2.128073 0.341976
C -1.726961 1.811321 0.268395
C 2.374614 -2.327801 1.285323
C 0.856612 -3.210545 -0.435685
C 3.703306 1.461792 -0.467685
C -2.798270 1.517322 1.148540
C -1.675216 3.060696 -0.400959
C -2.900541 -1.495386 0.097849
C 2.957571 -3.607262 1.424242
C 1.434763 -4.487712 -0.275992
C 2.490576 -4.689670 0.644232
C -3.829324 2.463872 1.327401
C -2.709076 3.998848 -0.206323
C 5.082634 1.169902 -0.656412
C 3.259955 2.811284 -0.482322
C -3.794532 3.705513 0.653305
C -3.500212 -0.784710 -0.986327
C -3.718933 -2.368821 0.872216
C 6.007503 2.213483 -0.854157
C 4.202333 3.844126 -0.679120
C 5.574231 3.560795 -0.865989
C -4.872077 -0.944180 -1.272494
C -5.092435 -2.508865 0.587947
C -5.680969 -1.799062 -0.486997
H 3.262393 -0.566835 -0.265395
H 2.695005 -1.500856 1.928962
H 0.034477 -3.049020 -1.136948
H -2.823506 0.572509 1.696733
H -0.827716 3.279328 -1.055736
H 3.760090 -3.759291 2.154025
H 1.061470 -5.325956 -0.873810
H 2.936967 -5.683141 0.759545
H -4.658578 2.227136 2.002728
H -2.667011 4.960991 -0.728982
H 5.427292 0.127464 -0.648031
H 2.200447 3.033374 -0.342101
H -4.597548 4.435983 0.798967
H -2.886220 -0.122561 -1.607118
H -3.248798 -2.929433 1.686848
H 7.066811 1.973997 -0.998750
H 3.854439 4.883359 -0.686887
H 6.293488 4.372010 -1.019191
H -5.312438 -0.391331 -2.110595
H -5.704513 -3.180851 1.200980
H -6.747073 -1.914219 -0.710961


