%chk=000261231.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261231

0 1
O 3.747258 2.052667 0.162111
O -3.747309 -2.052710 0.163257
O 5.692807 -2.007957 0.127991
O -5.692814 2.007918 0.126896
N 2.389073 0.207610 -0.056295
N -2.389128 -0.207809 -0.056492
N 4.807323 -0.007656 0.101611
N -4.807363 0.007582 0.101469
N 4.696044 -1.352237 0.099819
N -4.696063 1.352164 0.099081
C 1.125073 1.000844 -0.050607
C -1.125128 -1.001040 -0.050253
C 0.318259 0.695374 -1.327530
C 0.313859 0.697654 1.224364
C -0.318167 -0.696187 -1.327230
C -0.314060 -0.697237 1.224665
C 3.611598 0.844296 0.077895
C -3.611646 -0.844396 0.078241
C 6.119410 0.698371 0.136564
C -6.119458 -0.698417 0.136679
H 1.405193 2.094177 -0.049906
H -1.405251 -2.094372 -0.049052
H -0.464689 1.471193 -1.443952
H 0.970397 0.804861 -2.218626
H 0.961322 0.814411 2.117676
H -0.474214 1.469092 1.334945
H 0.464797 -1.472061 -1.443183
H -0.970201 -0.806107 -2.218349
H 0.473999 -1.468622 1.335710
H -0.961625 -0.813562 2.117958
H 2.305021 -0.805813 -0.100016
H -2.305069 0.805589 -0.100812
H 6.585476 0.691451 -0.862819
H 5.989929 1.750977 0.452170
H 6.802740 0.198250 0.844161
H -6.802879 -0.197866 0.843885
H -6.585393 -0.692101 -0.862769
H -5.990021 -1.750831 0.452945


%chk=000261231-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261231

0 1
O 3.401790 1.878037 1.142063
O -3.402059 -1.877613 1.142579
O 5.645506 -1.675063 -0.738449
O -5.645256 1.674931 -0.739607
N 2.352097 0.426460 -0.371241
N -2.352166 -0.426963 -0.371476
N 4.625245 0.082582 0.218076
N -4.625258 -0.082438 0.217711
N 4.553974 -1.013652 -0.635468
N -4.553893 1.013255 -0.636516
C 1.034682 1.104907 -0.341014
C -1.034822 -1.105529 -0.340850
C 0.241688 0.736680 -1.618681
C 0.227171 0.737418 0.934213
C -0.241599 -0.737724 -1.618493
C -0.227472 -0.737718 0.934382
C 3.405389 0.876195 0.374915
C -3.405550 -0.876226 0.374836
C 5.858890 0.439249 0.936991
C -5.858850 -0.438370 0.937078
H 1.235445 2.192339 -0.326184
H -1.235666 -2.192944 -0.325729
H -0.625094 1.423461 -1.684201
H 0.857160 0.933099 -2.516709
H 0.840163 0.957422 1.826332
H -0.656970 1.403852 0.982903
H 0.625186 -1.424534 -1.683655
H -0.856918 -0.934419 -2.516567
H 0.656653 -1.404153 0.983356
H -0.840581 -0.957482 1.826480
H 2.508635 -0.405080 -0.949296
H -2.508587 0.404315 -0.949940
H 6.668447 0.648089 0.216518
H 5.638670 1.329513 1.542502
H 6.178093 -0.400618 1.577845
H -6.177211 0.401547 1.578296
H -6.668831 -0.646428 0.216864
H -5.638999 -1.328895 1.542338


