%chk=000265293.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265293

0 1
O 1.974671 0.603305 1.165213
O 2.960111 1.494705 -1.781281
O 2.314054 -1.895465 -1.305871
O 4.881481 -0.083018 1.103840
O -4.485426 -0.053265 0.311879
N -0.010071 1.225347 0.064191
N -0.543307 -1.154319 -0.508510
N -2.919269 -1.691193 -0.345802
C 1.465315 1.264386 0.003407
C 2.041834 0.540172 -1.240892
C 2.782299 -0.712347 -0.696701
C 2.527055 -0.708240 0.830483
C 3.800582 -0.825884 1.674798
C -0.859475 0.128434 -0.104601
C -0.812011 2.327501 0.500856
C -2.203597 0.563939 0.189224
C -2.134116 1.947336 0.566402
C -3.212732 -0.417321 0.047036
C -1.602458 -1.994713 -0.604244
C -5.523014 -1.074743 0.162712
H 1.817876 2.324772 0.089219
H 1.284007 0.275023 -2.009228
H 3.873063 -0.699569 -0.942891
H 1.760078 -1.458055 1.124252
H 4.185129 -1.865024 1.684555
H 3.619606 -0.475121 2.708811
H -0.360354 3.280671 0.716289
H 3.378247 1.139231 -2.597060
H 1.334606 -2.013942 -1.155009
H -2.979641 2.549726 0.843843
H 4.640340 0.871193 1.059265
H -1.400857 -3.032094 -0.921146
H -5.551892 -1.425307 -0.873842
H -6.420371 -0.508909 0.436199
H -5.328466 -1.903913 0.850406


%chk=000265293-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265293

0 1
O 1.950580 0.413433 1.311405
O 3.250324 1.504845 -1.290689
O 1.794860 -1.933754 -1.150668
O 4.996548 0.291755 0.672010
O -4.611233 -0.011058 0.186296
N -0.060149 1.121952 0.135658
N -0.648782 -1.226456 -0.398776
N -3.033999 -1.699311 -0.336921
C 1.418051 1.129686 0.154852
C 2.139184 0.548979 -1.085830
C 2.645299 -0.872665 -0.669937
C 2.743421 -0.795063 0.884462
C 4.168334 -0.643026 1.436899
C -0.945082 0.062815 -0.058212
C -0.825362 2.257872 0.487276
C -2.277602 0.553016 0.157928
C -2.180724 1.947421 0.500271
C -3.311052 -0.410498 -0.003651
C -1.725702 -2.048120 -0.520352
C -5.666369 -1.039284 0.012520
H 1.702751 2.191809 0.255134
H 1.502609 0.491742 -1.987278
H 3.642680 -1.057980 -1.106464
H 2.254938 -1.678236 1.335317
H 4.689884 -1.614727 1.376932
H 4.103718 -0.336553 2.501156
H -0.324340 3.200039 0.703135
H 3.907418 1.110634 -1.918647
H 0.827516 -1.743389 -0.840025
H -2.999389 2.624670 0.728663
H 4.455752 1.095531 0.441832
H -1.525364 -3.087081 -0.793988
H -5.646655 -1.438623 -1.014771
H -6.602499 -0.500320 0.215159
H -5.516268 -1.866754 0.725106


