%chk=000251969.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251969

0 1
O 5.615881 -1.255577 -1.231212
O 6.202623 -0.028801 0.450155
N -2.220715 0.948123 0.274308
N -0.012787 1.115957 0.551490
N -1.004252 0.417118 0.141686
N 5.367263 -0.493155 -0.310037
N -2.525946 2.225891 0.829113
C -3.369913 0.089739 0.013371
C 1.305915 0.621798 0.295172
C 3.960479 -0.107220 -0.101228
C -3.236962 -1.308079 0.081553
C -4.597802 0.685497 -0.325158
C 1.640593 -0.256644 -0.755976
C 2.308477 1.135556 1.149006
C 2.968909 -0.620374 -0.953729
C 3.633540 0.770092 0.949181
C -4.346402 -2.107189 -0.204436
C -5.693714 -0.134545 -0.599348
C -5.572713 -1.527117 -0.542891
H -2.286795 -1.771414 0.347365
H -4.696976 1.771713 -0.366978
H 0.861999 -0.649285 -1.412316
H 2.034883 1.817165 1.956669
H 3.250489 -1.301736 -1.765230
H 4.428325 1.155525 1.598687
H -4.251174 -3.192450 -0.158707
H -6.650310 0.318508 -0.861358
H -6.432744 -2.158123 -0.761305
H -2.234450 2.268569 1.817379
H -1.988721 2.955958 0.337073


%chk=000251969-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251969

0 1
O 5.648694 -1.523235 -0.964312
O 6.319166 0.339695 0.175733
N -2.206324 0.786079 0.419211
N -0.012170 1.105070 0.587213
N -0.971520 0.279322 0.170016
N 5.399583 -0.436425 -0.304239
N -2.356687 2.088757 0.962076
C -3.361863 0.051252 0.014156
C 1.300801 0.647109 0.327919
C 3.992439 -0.062714 -0.087029
C -3.265194 -1.345453 -0.221280
C -4.601739 0.724873 -0.123749
C 1.627823 -0.540117 -0.399141
C 2.350885 1.467297 0.834450
C 2.967914 -0.892931 -0.605720
C 3.694472 1.118856 0.632481
C -4.418730 -2.058296 -0.599818
C -5.748091 -0.009730 -0.495557
C -5.665674 -1.400119 -0.734665
H -2.301584 -1.847383 -0.105671
H -4.650147 1.808025 0.018263
H 0.821282 -1.162381 -0.795897
H 2.082627 2.374573 1.384338
H 3.246343 -1.793341 -1.159808
H 4.513256 1.733889 1.014179
H -4.346197 -3.135758 -0.782508
H -6.704606 0.511566 -0.609273
H -6.558283 -1.964612 -1.023155
H -2.946349 2.075183 1.805254
H -1.393127 2.446449 1.108833


