%chk=000225636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225636

0 1
N 0.845698 0.110426 -0.528987
C -3.873209 -1.525663 -1.109272
C -2.755114 -0.648513 -0.593669
C -5.108681 -0.881769 -0.522848
C -3.287567 0.407355 0.213633
C -4.747535 0.261891 0.257332
C -1.396800 -0.762944 -0.813922
C -2.444447 1.344148 0.791965
C -6.433906 -1.257029 -0.656419
C -5.721811 1.016021 0.894333
C -0.544269 0.194821 -0.209853
C -1.060579 1.232611 0.582754
C -7.416580 -0.486197 -0.006138
C -7.067169 0.628998 0.754586
C 1.765611 0.093059 0.383205
C 3.172985 0.028263 -0.052503
C 5.603934 -0.052517 0.426289
C 4.188285 0.009354 0.823329
C 6.079258 0.659407 -0.687502
C 6.497918 -0.829829 1.184540
C 7.429872 0.589596 -1.039411
C 7.844752 -0.899757 0.823441
C 8.313755 -0.190238 -0.287698
H -3.758615 -2.575790 -0.779993
H -3.903500 -1.542418 -2.215846
H -0.976697 -1.550237 -1.436129
H -2.841896 2.154064 1.400300
H -6.718822 -2.123367 -1.246935
H -5.457831 1.886983 1.488291
H -0.391601 1.968647 1.022245
H -8.463380 -0.769765 -0.102680
H -7.842364 1.211908 1.248881
H 1.595059 0.113618 1.472869
H 3.332986 -0.009542 -1.135798
H 4.015536 0.030531 1.903657
H 5.396197 1.272507 -1.274014
H 6.138918 -1.384788 2.049370
H 7.793341 1.144821 -1.903028
H 8.532345 -1.507949 1.409293
H 9.364625 -0.245016 -0.565266


%chk=000225636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225636

0 1
N 0.817940 -0.096529 -0.661438
C -4.055825 -1.175149 -1.517245
C -2.859975 -0.552146 -0.805280
C -5.240428 -0.672838 -0.698546
C -3.308792 0.224698 0.309523
C -4.778014 0.152195 0.374397
C -1.497650 -0.641428 -1.112355
C -2.373199 0.914781 1.114474
C -6.614163 -0.913226 -0.871946
C -5.696485 0.737982 1.275175
C -0.543024 0.022459 -0.284884
C -0.999764 0.809615 0.819842
C -7.534941 -0.325181 0.032697
C -7.077620 0.493045 1.096281
C 1.791260 -0.019725 0.225789
C 3.179187 -0.062354 -0.193242
C 5.660750 -0.024809 0.380871
C 4.227582 0.004500 0.695751
C 6.164645 -0.105806 -0.952182
C 6.601467 0.031113 1.451300
C 7.550611 -0.131434 -1.197548
C 7.989517 0.004956 1.205126
C 8.471742 -0.076567 -0.121881
H -3.999142 -2.281415 -1.526508
H -4.118562 -0.854284 -2.575654
H -1.126130 -1.212794 -1.969156
H -2.706718 1.535761 1.953687
H -6.975144 -1.544548 -1.692246
H -5.350574 1.371703 2.099717
H -0.272935 1.369342 1.419797
H -8.609111 -0.503648 -0.090379
H -7.803592 0.939365 1.785283
H 1.601452 0.053657 1.318533
H 3.340591 -0.149437 -1.274455
H 3.980593 0.088088 1.765925
H 5.468976 -0.147039 -1.797243
H 6.231911 0.094090 2.482604
H 7.919085 -0.193144 -2.227651
H 8.693774 0.048155 2.043266
H 9.549409 -0.096308 -0.317796


