%chk=000287105.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287105

0 1
N 0.831245 2.060612 -0.133432
N -1.006023 -1.774957 1.013276
C 0.514926 -0.201758 -0.025640
C 1.937172 0.052175 -0.116615
C -0.133384 1.032805 -0.028222
C 2.110305 1.475105 -0.178103
C -1.557201 1.378952 0.024164
C -0.083057 -1.532403 0.036221
C 3.074892 -0.774910 -0.135376
C 3.382286 2.071564 -0.268924
C 4.325395 -0.185269 -0.224777
C 4.476792 1.223459 -0.292760
C -2.337251 0.980989 1.120333
C -2.138693 2.116429 -1.021775
C 0.300322 -2.531000 -0.889733
C -3.691534 1.324791 1.169555
C -3.491722 2.455509 -0.964318
C -0.279762 -3.794883 -0.799646
C -4.268507 2.062206 0.131762
C -1.560658 -3.013089 1.081829
C -1.225359 -4.050935 0.199652
H 0.632648 3.043091 -0.135102
H 2.960472 -1.855262 -0.072501
H 3.492919 3.149392 -0.315331
H 5.219292 -0.805913 -0.240536
H 5.481890 1.637507 -0.362187
H -1.884234 0.389381 1.922281
H -1.538906 2.408751 -1.881969
H 1.029005 -2.300589 -1.663741
H -4.296623 1.012399 2.019233
H -3.944165 3.022953 -1.775458
H -0.000908 -4.578316 -1.503980
H -5.323364 2.328109 0.173233
H -2.296304 -3.160845 1.880639
H -1.690502 -5.027549 0.291048


%chk=000287105-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287105

0 1
N 0.774990 1.993648 -0.206557
N -1.051387 -1.889305 1.063008
C 0.481011 -0.259079 0.026769
C 1.903048 0.019131 -0.152600
C -0.191249 0.988164 -0.003759
C 2.053501 1.442227 -0.285174
C -1.610702 1.397766 0.028141
C -0.078852 -1.621930 0.123987
C 3.072289 -0.789580 -0.164366
C 3.309160 2.068748 -0.436814
C 4.329345 -0.174378 -0.319399
C 4.448635 1.239898 -0.459745
C -2.565575 0.770310 0.875605
C -2.039293 2.488730 -0.787077
C 0.415801 -2.653290 -0.730046
C -3.900886 1.225647 0.905630
C -3.373701 2.942421 -0.748286
C -0.084086 -3.964320 -0.609842
C -4.313014 2.314244 0.102654
C -1.530533 -3.161962 1.158120
C -1.077683 -4.235172 0.359955
H 0.558878 2.988452 -0.189510
H 3.003727 -1.874607 -0.034743
H 3.400527 3.156488 -0.531719
H 5.235713 -0.789853 -0.325954
H 5.441125 1.688276 -0.579211
H -2.237816 -0.074526 1.489805
H -1.337182 2.954390 -1.490009
H 1.156443 -2.406938 -1.496525
H -4.621457 0.731226 1.567043
H -3.683716 3.774947 -1.390022
H 0.285738 -4.758397 -1.267656
H -5.350382 2.665743 0.134411
H -2.308040 -3.319560 1.915433
H -1.492973 -5.239058 0.491552


