%chk=000256395.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256395

0 1
N -1.210904 0.780512 1.759250
N -4.326408 2.461124 0.208945
C -0.032143 0.119342 -0.406534
C -0.380929 0.439474 -1.900787
C -1.199356 0.763704 0.370257
C -1.745704 1.161891 -1.915818
C -0.085623 -1.368370 -0.073213
C 1.326640 0.740527 -0.118927
C -2.130932 1.309015 -0.465025
C 0.767972 -1.919264 0.895261
C 2.475825 0.120438 -0.643843
C -1.047561 -2.191802 -0.679452
C 1.461823 1.941021 0.588660
C -3.334670 1.943169 -0.094452
C 0.682294 -3.274550 1.225528
C 3.736655 0.681354 -0.440208
C -1.131359 -3.546420 -0.347822
C 2.728863 2.500199 0.791954
C -0.264228 -4.093218 0.602850
C 3.867531 1.873017 0.282634
H -0.395229 -0.473944 -2.516047
H 0.397220 1.085972 -2.347044
H -2.508345 0.585834 -2.470935
H -1.674422 2.148702 -2.410181
H 1.513742 -1.297303 1.392587
H 2.380308 -0.805225 -1.211681
H -1.744144 -1.774818 -1.408012
H 0.585851 2.459104 0.982587
H -2.090215 0.971430 2.220403
H -0.631194 0.107455 2.240929
H 1.357119 -3.692752 1.971315
H 4.620484 0.192359 -0.846896
H -1.878024 -4.176247 -0.830041
H 2.822075 3.432420 1.347697
H -0.328059 -5.149185 0.858672
H 4.851447 2.309535 0.441987


%chk=000256395-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256395

0 1
N -1.087721 0.886004 1.796368
N -4.417397 2.252162 0.576081
C -0.011813 0.169934 -0.399469
C -0.419152 0.598285 -1.862661
C -1.148443 0.818370 0.424401
C -1.941237 0.925188 -1.850126
C -0.099390 -1.359269 -0.140531
C 1.390146 0.742023 -0.089693
C -2.205743 1.218454 -0.377053
C 0.537910 -1.932435 0.993383
C 2.555778 0.020878 -0.459334
C -0.887931 -2.208407 -0.957545
C 1.547174 2.052066 0.433616
C -3.408116 1.774416 0.129981
C 0.396793 -3.303154 1.297642
C 3.839620 0.585786 -0.298473
C -1.028142 -3.582872 -0.659972
C 2.831626 2.617045 0.601831
C -0.388866 -4.138066 0.470560
C 3.984858 1.886246 0.237781
H -0.138761 -0.167119 -2.605963
H 0.139083 1.516854 -2.111438
H -2.561511 0.077634 -2.203574
H -2.176061 1.787476 -2.500317
H 1.178649 -1.309803 1.629394
H 2.457790 -0.988116 -0.874901
H -1.404242 -1.805375 -1.833910
H 0.661518 2.637464 0.704155
H -1.889987 1.213534 2.332368
H -0.269384 0.554449 2.299529
H 0.903086 -3.719660 2.175794
H 4.725586 0.012158 -0.593411
H -1.641224 -4.217390 -1.309891
H 2.930039 3.628603 1.011848
H -0.499186 -5.203025 0.702636
H 4.981053 2.324161 0.365489


