%chk=000250066.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250066

0 1
O 4.779889 1.916719 -0.411998
N 0.156161 0.500803 0.022939
N -1.140799 0.969354 0.004047
N 3.142123 3.418799 0.069057
N 1.867615 3.771918 0.298376
C 0.171589 -0.923274 0.026338
C -1.952496 -0.119857 -0.012043
C -1.155086 -1.324549 0.002583
C 1.374092 -1.756132 0.078882
C 1.231873 1.436194 0.011273
C -3.414327 -0.030350 -0.035751
C 1.812521 -2.416891 -1.079570
C 2.063371 -1.920031 1.291125
C -4.167412 -1.047687 -0.647185
C -4.068963 1.066552 0.550239
C 2.526234 1.081845 -0.238766
C 0.931064 2.843140 0.278005
C 2.945455 -3.232594 -1.023001
C 3.194662 -2.738339 1.337385
C 3.637017 -3.392414 0.182423
C -5.561483 -0.967261 -0.664489
C -5.463941 1.138393 0.528624
C 3.592194 2.071782 -0.220751
C -6.211472 0.123099 -0.076264
H -1.531715 -2.328078 0.013513
H 1.270797 -2.291821 -2.017010
H 1.715624 -1.411738 2.190187
H -3.665752 -1.894116 -1.113760
H -3.485353 1.861011 1.017501
H 2.851622 0.064037 -0.470865
H -0.107663 3.163545 0.461967
H 3.291030 -3.743799 -1.921210
H 3.734232 -2.865282 2.275714
H 4.522511 -4.026424 0.221824
H -6.143616 -1.755676 -1.139274
H -5.968996 1.989300 0.983769
H -7.298538 0.181720 -0.091163
H 3.825139 4.190304 0.098626


%chk=000250066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250066

0 1
O 4.666475 2.258110 -0.684368
N 0.175346 0.472609 0.158872
N -1.145605 0.952625 0.176003
N 3.036158 3.456119 0.491410
N 1.798512 3.677002 1.039847
C 0.223276 -0.920248 -0.057177
C -1.924038 -0.148122 -0.047809
C -1.108848 -1.323047 -0.198617
C 1.430127 -1.773882 -0.016123
C 1.212828 1.443053 0.231423
C -3.393148 -0.032171 -0.105673
C 1.609929 -2.774151 -1.008746
C 2.381638 -1.669460 1.035695
C -4.204231 -1.175703 -0.336847
C -4.023217 1.231344 0.067645
C 2.466689 1.264097 -0.337143
C 0.908873 2.687870 0.911930
C 2.719795 -3.645088 -0.956877
C 3.492536 -2.536910 1.081545
C 3.667338 -3.526884 0.085699
C -5.609285 -1.060207 -0.392695
C -5.426418 1.344333 0.011492
C 3.487665 2.300603 -0.220608
C -6.227232 0.199580 -0.218610
H -1.438395 -2.350236 -0.333772
H 0.886371 -2.853047 -1.827871
H 2.244453 -0.921284 1.823796
H -3.740620 -2.158902 -0.474233
H -3.398178 2.112772 0.241922
H 2.745459 0.367297 -0.891857
H -0.079949 2.864124 1.334546
H 2.848908 -4.406877 -1.733247
H 4.218751 -2.444078 1.896070
H 4.532826 -4.197106 0.122506
H -6.221323 -1.951105 -0.571667
H -5.898404 2.323928 0.145976
H -7.318262 0.288982 -0.262135
H 3.702404 4.226258 0.600992


