%chk=000198103.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198103

0 1
S 1.449637 0.996679 -0.286624
O 2.353600 1.486558 -1.311054
O 1.171409 1.833431 0.846193
N -0.014891 0.804339 -1.227749
N 3.804284 -2.118914 0.679879
N -1.002342 -0.493483 0.451683
C 1.926087 -0.607547 0.192346
C 3.451149 -0.721097 0.294011
C -1.173907 0.200276 -0.725487
C -2.420854 0.270979 -1.395719
C -3.509184 -0.376897 -0.818896
C -2.088760 -1.107596 0.986478
C -3.354659 -1.075132 0.386321
H 1.469104 -0.902657 1.174429
H 1.521745 -1.396767 -0.478043
H 3.923536 -0.394915 -0.663770
H 3.833199 -0.041869 1.093393
H -0.102057 1.301837 -2.123247
H -2.524530 0.821461 -2.324627
H 4.792992 -2.186796 0.902398
H 3.621681 -2.763175 -0.082850
H -4.485490 -0.338987 -1.305063
H -1.913514 -1.640446 1.929957
H -4.198037 -1.577983 0.848944


%chk=000198103-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198103

0 1
S 1.492022 0.940987 -0.711008
O 2.321589 1.650427 -1.919116
O 1.227205 1.760772 0.666888
N -0.134843 0.442800 -1.594473
N 4.051480 -1.966591 0.922211
N -0.980311 -0.782570 0.232589
C 2.244774 -0.798939 -0.283799
C 3.514556 -0.645359 0.582920
C -1.243518 0.031737 -0.838587
C -2.570744 0.391599 -1.217915
C -3.646297 -0.139712 -0.481388
C -2.037256 -1.255878 0.948366
C -3.384892 -0.978808 0.629271
H 1.394613 -1.282183 0.226319
H 2.430194 -1.231811 -1.280538
H 4.284343 -0.065422 0.044322
H 3.273768 -0.094532 1.508477
H -0.292971 1.126975 -2.349707
H -2.744188 1.064060 -2.064440
H 3.503831 -2.529484 1.575238
H 4.478929 -2.499013 0.162655
H -4.675063 0.113045 -0.759064
H -1.782856 -1.884212 1.809450
H -4.194168 -1.396587 1.234233


