%chk=000221346.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221346

0 1
N 0.285352 -0.368011 0.051583
C 1.519373 -1.219658 0.027157
C 3.205112 0.902271 -0.038577
C 2.663838 -0.417921 -0.656918
C 1.299697 -2.500074 -0.830033
C 1.873572 -1.649255 1.458389
C 2.099956 1.948646 0.162589
C 3.926528 0.655126 1.299451
C 4.241502 1.469907 -1.043816
C -0.932295 -1.024477 0.621500
C -2.179265 -0.300198 0.174668
C -2.307701 1.080225 0.394205
C -3.221050 -1.003463 -0.446531
C -3.467773 1.747980 -0.003858
C -4.382214 -0.331071 -0.840057
C -4.507952 1.043720 -0.620313
H 2.342165 -0.188099 -1.692889
H 3.524262 -1.108937 -0.763662
H 0.473739 -3.103881 -0.440195
H 1.066664 -2.259998 -1.870506
H 2.189118 -3.136044 -0.830815
H 1.135073 -2.334907 1.881917
H 2.846159 -2.150040 1.490398
H 1.930735 -0.770541 2.120513
H 0.080696 -0.017496 -0.891000
H 2.505098 2.900126 0.516372
H 1.550921 2.141072 -0.763117
H 1.361921 1.605528 0.901578
H 4.441589 1.556816 1.644645
H 3.212989 0.369906 2.084594
H 4.670561 -0.141265 1.219021
H 5.065484 0.771886 -1.213140
H 4.676539 2.403277 -0.673477
H 3.784223 1.690280 -2.012276
H -0.849835 -0.962182 1.733443
H -0.994981 -2.109181 0.374662
H -1.492678 1.625704 0.871780
H -3.131448 -2.072882 -0.624102
H -3.562950 2.818833 0.167189
H -5.189667 -0.881136 -1.319788
H -5.411759 1.565016 -0.927584


%chk=000221346-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221346

0 1
N 0.250635 -0.631926 -0.212927
C 1.553692 -1.315709 0.062857
C 3.168172 0.933232 -0.001581
C 2.690694 -0.446313 -0.576939
C 1.627791 -2.718160 -0.631458
C 1.715194 -1.523857 1.589278
C 2.005453 1.909976 0.313287
C 4.056070 0.759855 1.264025
C 4.058015 1.577128 -1.107359
C -1.007971 -1.282176 0.205578
C -2.213197 -0.376206 -0.040592
C -2.129153 1.023288 0.176472
C -3.447944 -0.927746 -0.465075
C -3.258432 1.849223 -0.018145
C -4.581087 -0.103880 -0.656545
C -4.490021 1.289269 -0.433071
H 2.378459 -0.271028 -1.631170
H 3.591146 -1.092625 -0.640448
H 0.782755 -3.360385 -0.321813
H 1.595227 -2.613265 -1.732964
H 2.563047 -3.245616 -0.365719
H 1.030876 -2.310393 1.957829
H 2.743921 -1.846485 1.826545
H 1.497954 -0.594270 2.141367
H 0.199602 -0.322043 -1.193599
H 2.414943 2.878738 0.661359
H 1.387642 2.099746 -0.584085
H 1.333564 1.507272 1.088777
H 4.503262 1.731886 1.548056
H 3.484193 0.391968 2.131295
H 4.885717 0.051434 1.074067
H 4.899293 0.912487 -1.384147
H 4.484479 2.535284 -0.754923
H 3.470360 1.782855 -2.022258
H -0.935645 -1.493262 1.291087
H -1.201900 -2.265499 -0.289290
H -1.168786 1.446663 0.489081
H -3.522592 -2.007368 -0.648412
H -3.179747 2.929053 0.154195
H -5.528686 -0.546217 -0.985080
H -5.365701 1.930675 -0.584557


