%chk=000221207.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221207

0 1
O 3.153614 -0.623324 1.899904
O -1.560235 -1.551791 2.011853
O -0.806148 -0.121877 -1.910043
N 0.174404 -0.849574 0.013201
C 2.247728 0.607679 -0.046920
C 1.546294 -0.701230 -0.514966
C -2.313883 -0.571317 -0.052217
C 2.470813 0.570284 1.486983
C 3.605488 0.698260 -0.764817
C 1.395176 1.836339 -0.386098
C -0.926889 -0.486425 -0.747618
C -2.431983 -1.796665 0.882868
C -2.504070 0.727345 0.738506
C -3.377334 -0.712891 -1.148066
H 1.509886 -0.723896 -1.630609
H 2.143385 -1.578684 -0.176372
H 1.518016 0.506621 2.044413
H 3.037225 1.448963 1.838524
H 3.472969 0.784159 -1.850808
H 4.227455 -0.183722 -0.582934
H 4.171473 1.579909 -0.445603
H 0.490429 1.891877 0.229569
H 1.947582 2.770897 -0.256235
H 1.049287 1.795249 -1.430458
H 0.083094 -1.074029 1.010505
H -3.461622 -1.902800 1.268459
H -2.117392 -2.727623 0.380919
H -2.327773 1.609946 0.112213
H -3.521126 0.806898 1.138409
H -1.819035 0.769197 1.597409
H -3.248718 0.075428 -1.908669
H -4.392716 -0.628721 -0.751757
H -3.290709 -1.663633 -1.686283
H 4.043213 -0.660707 1.496352
H -1.510998 -2.350342 2.572389


%chk=000221207-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221207

0 1
O 3.115909 -0.779390 1.901334
O -1.372070 -1.471305 2.050315
O -0.935441 0.071349 -1.986591
N 0.145549 -0.747107 -0.090152
C 2.296057 0.612268 -0.054368
C 1.502975 -0.604054 -0.629310
C -2.343639 -0.582840 -0.056516
C 2.452047 0.469144 1.484858
C 3.690310 0.632934 -0.732359
C 1.548930 1.937638 -0.339654
C -0.982242 -0.404228 -0.806819
C -2.341347 -1.748986 0.960549
C -2.661282 0.760459 0.662189
C -3.439628 -0.891057 -1.107390
H 1.412622 -0.493735 -1.724548
H 2.070899 -1.526747 -0.404088
H 1.460228 0.424828 1.967063
H 2.993444 1.354648 1.884168
H 3.593609 0.828136 -1.815842
H 4.218610 -0.334857 -0.622135
H 4.328597 1.429616 -0.303867
H 0.559975 1.950372 0.153690
H 2.129282 2.807031 0.024916
H 1.377730 2.061796 -1.423424
H 0.001805 -1.100913 0.868898
H -3.359404 -1.845804 1.389785
H -2.070301 -2.696290 0.448765
H -2.667921 1.585504 -0.071627
H -3.657660 0.711755 1.140988
H -1.914569 0.980637 1.443895
H -3.381954 -0.149239 -1.920053
H -4.444180 -0.850534 -0.646802
H -3.298538 -1.889210 -1.562861
H 4.063169 -0.748230 1.615609
H -1.414669 -2.183789 2.733386


