%chk=000255318.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255318

0 1
S -4.213708 -1.118303 -0.982406
O -4.045577 -2.130735 0.369551
O -5.538528 -1.389234 -1.474010
O -3.054038 -1.380952 -1.781780
O 3.708068 -3.047431 0.979849
O 1.575837 -2.807554 1.212502
O 5.688856 2.347470 -1.221021
O 6.526014 0.431695 -0.658454
N 0.388339 -0.598778 0.582104
N -0.669704 0.267347 0.433590
N 2.690481 -2.389149 0.892017
N 5.594747 1.204863 -0.804224
C -4.125544 0.409599 -0.201107
C -2.994829 0.793274 0.538623
C 1.657757 -0.156574 0.230956
C 2.787154 -1.024416 0.384850
C -5.208888 1.288943 -0.319391
C -2.946617 2.058969 1.139995
C 1.877840 1.164002 -0.275206
C 4.076255 -0.564179 0.037079
C 4.251087 0.724495 -0.447325
C -1.868854 -0.160057 0.708326
C -5.163608 2.548029 0.283670
C 3.136952 1.596045 -0.607350
C -4.030536 2.932184 1.009168
H -6.100469 0.988796 -0.885975
H -2.062045 2.360347 1.703717
H 1.014325 1.827896 -0.402763
H 4.944092 -1.240026 0.155865
H -2.157966 -1.175121 1.053421
H -6.009836 3.229045 0.188412
H 3.310646 2.608075 -0.999229
H -3.991295 3.918531 1.477179
H 0.252377 -1.596225 0.892041
H -4.537985 -2.964070 0.349228


%chk=000255318-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255318

0 1
S -4.748062 -1.489973 -0.165506
O -4.134625 -1.960895 1.526443
O -6.351556 -1.671445 -0.244521
O -3.802879 -2.242769 -1.245781
O 3.658463 -3.249723 -0.126443
O 1.404500 -2.931905 -0.135511
O 6.018518 2.553119 0.207093
O 6.766745 0.396239 0.093116
N 0.420921 -0.519427 -0.018172
N -0.609161 0.395686 0.035484
N 2.635011 -2.473262 -0.098245
N 5.822731 1.276459 0.133811
C -4.330517 0.345505 0.008535
C -2.986068 0.799886 0.045061
C 1.734327 -0.091284 0.020106
C 2.836724 -1.022529 -0.020343
C -5.453208 1.183060 0.081338
C -2.815821 2.213349 0.156459
C 2.046371 1.304159 0.101181
C 4.173815 -0.572143 0.016561
C 4.425592 0.801995 0.094734
C -1.831057 -0.103791 -0.015382
C -5.242184 2.574860 0.187775
C 3.365656 1.749141 0.138015
C -3.920031 3.081320 0.225331
H -6.460001 0.754208 0.050605
H -1.792609 2.597825 0.189706
H 1.211458 2.005916 0.132222
H 4.994387 -1.293509 -0.015277
H -2.018439 -1.184830 -0.111936
H -6.100029 3.251727 0.242747
H 3.608089 2.813213 0.199254
H -3.754734 4.160360 0.309155
H 0.283641 -1.551554 -0.083967
H -4.295168 -2.942188 1.648254


