%chk=000266060.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266060

0 1
S 1.469543 1.751770 -0.618021
O 2.056372 2.098171 -1.895502
O 1.323593 2.733806 0.429283
N -0.105573 1.196900 -1.087664
N -4.511756 -1.419114 -1.586743
C -1.189654 0.928081 -0.221115
C -2.297742 0.132681 -0.719728
C 2.218567 0.341505 0.010899
C -3.358539 -0.173842 0.168398
C -1.207061 1.386103 1.086540
C 2.996895 -0.466503 -0.828537
C 2.068483 -0.002650 1.360013
C -3.334980 0.290799 1.515156
C -2.377921 -0.360527 -2.057906
C 3.456237 -1.964786 1.023714
C -2.281268 1.056651 1.951520
C 3.611426 -1.613302 -0.329687
C 2.679683 -1.148817 1.865885
C -4.452276 -0.966702 -0.339919
C -3.466883 -1.111009 -2.445433
C 4.097911 -3.199868 1.557558
H -0.310798 1.116812 -2.094402
H -0.424594 2.050223 1.470680
H 3.131851 -0.192108 -1.881893
H 1.473888 0.632030 2.027019
H -4.159761 0.037245 2.176881
H -1.579452 -0.144237 -2.765324
H -2.254095 1.435590 2.974249
H 4.213873 -2.236422 -0.988682
H 2.555367 -1.411119 2.915347
H -5.289052 -1.217682 0.325005
H -3.574252 -1.511064 -3.458692
H 5.023324 -3.460676 1.024463
H 4.357039 -3.115292 2.622666
H 3.419405 -4.063148 1.461469


%chk=000266060-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266060

0 1
S 1.494182 1.964562 -0.576013
O 2.146111 2.333139 -2.018977
O 1.478865 3.005273 0.669673
N -0.211065 1.551397 -1.057969
N -4.171616 -1.755152 -1.550301
C -1.247334 1.132738 -0.198026
C -2.192974 0.144917 -0.677625
C 2.223353 0.342436 0.049043
C -3.285730 -0.246047 0.186496
C -1.380359 1.649550 1.103735
C 2.774596 -0.534187 -0.899379
C 2.212312 0.089483 1.429516
C -3.385762 0.288830 1.510051
C -2.122368 -0.471485 -1.968657
C 3.326062 -2.062738 0.958530
C -2.433969 1.207881 1.957793
C 3.329780 -1.742440 -0.426352
C 2.769757 -1.129897 1.873523
C -4.236493 -1.193899 -0.327858
C -3.102161 -1.390550 -2.352943
C 3.894792 -3.381265 1.447910
H -0.323458 1.654632 -2.070073
H -0.680866 2.418978 1.445144
H 2.793949 -0.267852 -1.961108
H 1.808645 0.827379 2.129463
H -4.212958 -0.027292 2.155357
H -1.296459 -0.251641 -2.652879
H -2.504812 1.629256 2.966333
H 3.775564 -2.443099 -1.141422
H 2.777269 -1.354819 2.945994
H -5.084224 -1.496518 0.300998
H -3.064616 -1.879684 -3.331906
H 4.702637 -3.745109 0.789927
H 4.297082 -3.295112 2.471924
H 3.110069 -4.162166 1.467573


