%chk=000276068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276068

0 1
S -1.297335 2.239263 -0.489304
O 3.564170 -0.559705 0.658801
O 3.304621 -1.199035 -1.511771
N 0.800597 0.767071 -0.501325
N -0.182634 -0.155512 -0.261782
N 1.526153 2.884471 -0.869704
N 2.586985 2.057256 -0.865989
C -1.354108 0.447991 -0.221942
C 0.413997 2.147711 -0.650760
C -2.651792 -0.178386 -0.012463
C 2.198585 0.764579 -0.648338
C -2.971757 -1.361728 -0.701821
C -3.580017 0.398833 0.871799
C 3.071473 -0.440232 -0.607400
C -4.222276 -1.954500 -0.513340
C -4.826258 -0.204420 1.052581
C 4.514372 -1.651260 0.919766
C -5.149402 -1.377034 0.360271
C 5.863767 -1.306773 0.331886
H -2.243044 -1.814411 -1.377487
H -3.330975 1.304420 1.426166
H -4.473163 -2.871029 -1.048092
H -5.548447 0.239438 1.738128
H 4.503258 -1.656307 2.026105
H 4.091148 -2.586733 0.514226
H -6.124794 -1.842557 0.504588
H 6.639645 -2.005931 0.666329
H 5.845066 -1.336901 -0.768502
H 6.182067 -0.293981 0.617771


%chk=000276068-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276068

0 1
S -1.326020 2.483807 0.091767
O 4.283289 -0.145359 0.588193
O 2.425310 -1.551840 0.338751
N 0.769434 0.910954 0.258259
N -0.254872 -0.024363 0.176604
N 1.549054 3.044452 0.323108
N 2.645257 2.130506 0.411115
C -1.421536 0.605576 0.084179
C 0.445877 2.275896 0.234071
C -2.708153 -0.085006 -0.016239
C 2.161031 0.853566 0.371143
C -2.728852 -1.510310 -0.012454
C -3.930395 0.632247 -0.115980
C 2.933509 -0.406082 0.424419
C -3.954638 -2.194954 -0.106622
C -5.153832 -0.061261 -0.209903
C 5.184316 -1.342419 0.621338
C -5.170572 -1.475502 -0.205481
C 5.565418 -1.768772 -0.798624
H -1.782351 -2.054296 0.064818
H -3.931638 1.729002 -0.120692
H -3.964785 -3.289881 -0.103017
H -6.091258 0.499068 -0.286339
H 6.052426 -0.983996 1.195955
H 4.671018 -2.155006 1.165026
H -6.122250 -2.012674 -0.278513
H 6.310990 -2.584134 -0.752252
H 4.684586 -2.138870 -1.349395
H 6.009538 -0.925752 -1.354838


