%chk=000297952.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297952

0 1
O -3.395757 1.066880 -1.439502
N -0.306803 2.663723 1.003253
N 4.274151 -0.527137 -1.386259
N -3.981072 -0.479627 0.126605
C 0.397070 0.308724 1.147606
C 0.856393 1.756254 0.757751
C -0.839592 -0.119252 0.334461
C -1.971707 0.902170 0.526041
C 1.471608 1.871041 -0.672852
C -1.494314 2.324170 0.158447
C 1.509521 -0.689790 0.931796
C 2.456022 -0.350266 -0.049465
C 2.522083 0.841211 -0.855083
C 0.053738 4.103358 0.850054
C 3.553015 -1.193197 -0.384765
C -3.156913 0.531375 -0.367865
C 1.679515 -1.900838 1.582279
C 3.635530 0.716354 -1.664071
C 3.714944 -2.428099 0.282386
C 2.774488 -2.748132 1.248982
C -5.163157 -0.968889 -0.640754
C -6.426641 -0.794503 0.209287
C -4.949134 -2.435303 -1.032949
H 0.124905 0.337366 2.233334
H 1.655886 2.053413 1.488723
H -0.571698 -0.200177 -0.739416
H -1.164494 -1.129432 0.643878
H -2.283209 0.910062 1.600737
H 1.874722 2.889636 -0.825285
H 0.679370 1.735405 -1.440074
H -1.298596 2.384688 -0.936056
H -2.303535 3.055161 0.374346
H -0.774209 4.715117 1.246183
H 0.254939 4.425002 -0.182420
H 0.940922 4.327002 1.463587
H 0.986626 -2.222399 2.353325
H 4.031026 1.384690 -2.404548
H 5.101383 -0.857889 -1.837910
H 4.538973 -3.090053 0.046454
H 2.866729 -3.691788 1.787825
H -3.783256 -0.943404 1.004616
H -5.248290 -0.340807 -1.573365
H -7.318272 -1.095210 -0.352676
H -6.401744 -1.393194 1.125390
H -6.565086 0.253393 0.503768
H -4.036154 -2.556641 -1.629566
H -5.784652 -2.802496 -1.639729
H -4.863875 -3.094069 -0.163007


%chk=000297952-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297952

0 1
O -3.005388 0.267693 -1.766956
N -0.410519 2.413320 1.010615
N 4.580888 -0.168897 -1.351231
N -4.173209 -0.461476 0.114891
C 0.519031 0.117348 1.042989
C 0.825733 1.628653 0.756253
C -0.682376 -0.366988 0.182435
C -1.929396 0.524963 0.427308
C 1.476924 1.886692 -0.658897
C -1.571526 2.013829 0.186601
C 1.750332 -0.750950 0.818886
C 2.700616 -0.266150 -0.105544
C 2.663624 0.971511 -0.839096
C -0.210803 3.872392 1.059514
C 3.897851 -0.972468 -0.427653
C -3.071951 0.108416 -0.506504
C 2.029302 -1.990729 1.427109
C 3.833224 1.009698 -1.595047
C 4.174849 -2.222722 0.174479
C 3.222500 -2.709503 1.100147
C -5.363694 -0.942378 -0.620121
C -6.598799 -0.073021 -0.288425
C -5.612790 -2.438879 -0.327318
H 0.210858 0.062704 2.107073
H 1.570184 1.952650 1.512227
H -0.422998 -0.340813 -0.892769
H -0.910078 -1.421658 0.428802
H -2.235950 0.416357 1.488460
H 1.766401 2.951338 -0.737493
H 0.723552 1.703380 -1.451055
H -1.413914 2.161312 -0.908275
H -2.427998 2.652561 0.476813
H -1.113243 4.354467 1.479271
H -0.009628 4.344045 0.066155
H 0.640585 4.105646 1.724702
H 1.335121 -2.414737 2.163136
H 4.203053 1.764311 -2.287296
H 5.478173 -0.386272 -1.778316
H 5.080837 -2.796743 -0.049219
H 3.409257 -3.672441 1.589888
H -4.169180 -0.548251 1.133768
H -5.105228 -0.813078 -1.686773
H -7.473838 -0.405083 -0.876355
H -6.863737 -0.148696 0.784156
H -6.403113 0.987223 -0.525121
H -4.726759 -3.042495 -0.590492
H -6.472304 -2.807924 -0.915672
H -5.843073 -2.604553 0.743445


