%chk=000216789.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216789

0 1
O 0.052279 1.449483 0.081069
N -0.162268 -0.956064 0.064840
N -2.013300 0.569655 0.316244
C 1.302062 -1.178651 0.001294
C 2.041352 0.110207 -0.469184
C 1.509669 1.346646 0.254100
C 1.794787 -1.599730 1.398509
C 1.542759 -2.310235 -1.012404
C -0.654611 0.242916 0.131373
C 2.020434 2.658567 -0.317574
C -3.013105 -0.456572 -0.112461
C -4.419537 0.120570 -0.005982
H 1.911264 0.227698 -1.562452
H 3.128179 0.009636 -0.308871
H 1.665620 1.281299 1.354328
H 1.656361 -0.805163 2.138202
H 1.223520 -2.465714 1.760040
H 2.851127 -1.878476 1.387293
H 2.603768 -2.555071 -1.099500
H 1.006678 -3.218965 -0.706819
H 1.163925 -2.048540 -2.006495
H 3.102654 2.760342 -0.185924
H 1.797104 2.747945 -1.388731
H 1.534045 3.512898 0.173712
H -2.249050 1.534144 0.066726
H -2.810370 -0.821212 -1.144588
H -2.890355 -1.338276 0.562543
H -4.622400 0.505344 1.003147
H -4.590150 0.940407 -0.712793
H -5.170241 -0.652090 -0.213943


%chk=000216789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216789

0 1
O 0.043329 1.520459 -0.089053
N -0.194103 -0.925717 -0.007451
N -2.029565 0.563012 -0.091211
C 1.280980 -1.152253 -0.012630
C 2.053207 0.125785 -0.462319
C 1.500067 1.390658 0.217005
C 1.711644 -1.592396 1.413255
C 1.558491 -2.306937 -1.004687
C -0.676684 0.284867 -0.054881
C 2.144029 2.691996 -0.258414
C -3.043626 -0.492920 -0.198649
C -4.435374 0.050630 0.166623
H 1.952846 0.248734 -1.558993
H 3.130540 0.024525 -0.230624
H 1.588707 1.300979 1.319571
H 1.581572 -0.777663 2.148616
H 1.083734 -2.439276 1.740243
H 2.770644 -1.912781 1.424037
H 2.638231 -2.544808 -1.046177
H 1.006311 -3.209557 -0.689826
H 1.214547 -2.035997 -2.018829
H 3.217815 2.704721 0.002860
H 2.046666 2.794253 -1.353604
H 1.657987 3.562096 0.215998
H -2.299484 1.544091 -0.151341
H -3.054873 -0.919842 -1.224084
H -2.751398 -1.317057 0.476643
H -4.453612 0.427469 1.205112
H -4.738616 0.874518 -0.507784
H -5.191812 -0.748592 0.076294


