%chk=000229968.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229968

1 1
N -3.672603 0.000616 0.011666
C -2.168304 0.001938 0.047601
C -4.152751 -1.263494 -0.677473
C -4.153331 1.217403 -0.757609
C -4.294987 0.045200 1.392777
C -1.479759 -0.036336 -1.179337
C -1.461427 0.039469 1.256187
C 0.633473 0.000967 0.018499
C -0.087537 -0.036640 -1.188934
C -0.064576 0.038815 1.234987
C 2.113324 0.000516 0.003633
C 2.810717 -1.215842 0.033629
C 2.810699 1.216463 -0.040395
C 4.208209 -1.211385 0.019353
C 4.208186 1.211169 -0.054386
C 4.907018 -0.000320 -0.024607
H -3.763150 -2.166371 -0.166691
H -5.255668 -1.332662 -0.690338
H -3.808645 -1.318779 -1.727255
H -3.809601 1.204851 -1.808898
H -5.256277 1.285231 -0.774574
H -3.763893 2.151526 -0.306354
H -4.001425 0.958719 1.945424
H -5.400604 0.043601 1.338417
H -4.001712 -0.830906 2.003132
H -2.013498 -0.066005 -2.130778
H -1.960077 0.069550 2.226004
H 0.455319 -0.066261 -2.139727
H 0.493969 0.068092 2.176870
H 2.269927 -2.160202 0.068073
H 2.269888 2.161158 -0.063450
H 4.755088 -2.155129 0.042665
H 4.755054 2.154589 -0.088523
H 5.998253 -0.000643 -0.035588


%chk=000229968-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229968

1 1
N -3.721747 0.000358 0.006229
C -2.191012 0.009260 0.037601
C -4.224108 -1.419555 -0.295808
C -4.221051 0.966556 -1.079191
C -4.338785 0.437111 1.334067
C -1.495145 -0.374405 -1.132164
C -1.481170 0.388467 1.195518
C 0.660981 0.004261 0.015416
C -0.088743 -0.371757 -1.136427
C -0.071154 0.379712 1.174901
C 2.147582 0.003465 0.003569
C 2.868204 -0.927323 -0.795923
C 2.881292 0.933506 0.791945
C 4.278064 -0.929270 -0.804609
C 4.291077 0.933739 0.779533
C 4.995596 0.001761 -0.017849
H -3.853793 -2.094746 0.489481
H -5.325310 -1.412332 -0.311671
H -3.837845 -1.744768 -1.270990
H -3.836794 0.648086 -2.057362
H -5.322287 0.955781 -1.086660
H -3.845952 1.974207 -0.847780
H -4.022578 1.463944 1.566500
H -5.433738 0.404035 1.228528
H -4.025039 -0.252552 2.130525
H -2.016746 -0.665594 -2.050375
H -1.981536 0.679836 2.121841
H 0.434427 -0.638936 -2.059485
H 0.466084 0.643766 2.090872
H 2.330180 -1.679280 -1.384640
H 2.352823 1.686280 1.388147
H 4.817075 -1.660359 -1.415885
H 4.840060 1.664411 1.382367
H 6.090389 0.001230 -0.026224


