%chk=000208743.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208743

0 1
N 2.747021 0.938273 -0.026596
C 0.572587 -0.167248 0.402902
C 1.436911 0.581544 -0.673401
C 1.124166 0.375187 1.754636
C 0.780602 1.890304 -1.143946
C 2.462191 1.074712 1.441225
C 0.842429 -1.691098 0.297501
C -0.919310 0.097543 0.304151
C -0.608211 1.598280 -1.714481
C -1.477476 0.917009 -0.694854
C 0.298244 -2.311965 -0.995531
C 3.797268 -0.086346 -0.299205
C -1.774708 -0.499497 1.246570
C -2.867961 1.107192 -0.748935
C 0.658060 -3.791265 -1.107448
C -3.155147 -0.303687 1.191321
C -3.704901 0.499099 0.186889
H 1.597978 -0.075293 -1.562696
H 1.252619 -0.428756 2.494619
H 0.412241 1.090284 2.203200
H 1.424388 2.380781 -1.897843
H 0.706960 2.607480 -0.302770
H 2.394351 2.164780 1.646307
H 3.285374 0.685099 2.066376
H 0.399460 -2.210005 1.168411
H 1.936715 -1.868933 0.368932
H -0.530367 0.954753 -2.616094
H -1.073606 2.542283 -2.062321
H 0.692640 -1.760442 -1.873357
H -0.803338 -2.188241 -1.034774
H 4.011148 -0.095320 -1.379904
H 3.529821 -1.110730 0.013040
H 4.727991 0.206160 0.211017
H -1.355688 -1.127536 2.031755
H -3.297153 1.736998 -1.525769
H 1.742441 -3.946356 -1.116436
H 0.250415 -4.369965 -0.270707
H 0.256768 -4.225821 -2.030108
H -3.801795 -0.775015 1.927818
H -4.780832 0.651760 0.137206


%chk=000208743-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208743

0 1
N 2.658114 1.022875 0.258595
C 0.554129 -0.216302 0.482917
C 1.490516 0.541099 -0.540231
C 1.147598 0.211904 1.870987
C 0.801530 1.710539 -1.276508
C 2.650591 0.379064 1.588847
C 0.730128 -1.770492 0.323871
C -0.938162 0.128109 0.357463
C -0.532608 1.244021 -1.895989
C -1.471612 0.771844 -0.795817
C 0.196566 -2.391116 -0.987637
C 3.949346 1.040801 -0.436917
C -1.828592 -0.262513 1.391377
C -2.867041 1.001861 -0.884878
C 0.380977 -3.924245 -1.018374
C -3.217501 -0.033933 1.294910
C -3.743830 0.599024 0.145226
H 1.826651 -0.191117 -1.314079
H 0.946529 -0.532383 2.661936
H 0.716533 1.179833 2.183310
H 1.479528 2.107476 -2.056955
H 0.618156 2.525643 -0.552191
H 3.154593 1.021943 2.335309
H 3.171961 -0.612575 1.595695
H 0.211814 -2.262800 1.172765
H 1.807013 -2.017938 0.426009
H -0.334604 0.420214 -2.614598
H -1.005374 2.059243 -2.474302
H 0.717188 -1.945881 -1.859434
H -0.876434 -2.144471 -1.101565
H 3.868830 1.614634 -1.377564
H 4.333529 0.018434 -0.689194
H 4.707608 1.540556 0.193674
H -1.429376 -0.752556 2.287675
H -3.265785 1.508472 -1.772973
H 1.449289 -4.201568 -0.935352
H -0.155592 -4.404554 -0.178167
H -0.008432 -4.357770 -1.957899
H -3.883018 -0.343715 2.108678
H -4.820459 0.784345 0.058081


