%chk=000193401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193401

0 1
S 0.466216 -0.905573 -0.997229
S -1.103763 -0.224939 0.140564
O 4.718922 -1.002411 -0.931589
O 5.285694 1.057891 -0.263118
O -5.036495 -0.381654 1.241298
O -2.876869 0.122301 1.613651
N 3.602084 0.205613 2.034913
N -4.723022 0.708553 -1.289947
C 2.183022 0.983456 0.061916
C 3.222950 -0.011649 0.620255
C 1.568809 0.515163 -1.245355
C -3.656778 -0.151322 -0.704917
C -2.285605 0.405833 -1.099587
C 4.514861 0.133009 -0.184045
C -3.768046 -0.089990 0.819506
H 1.390599 1.154727 0.823068
H 2.653132 1.981458 -0.082798
H 2.842877 -1.071105 0.519758
H 2.344761 0.168993 -1.962916
H 1.027438 1.340499 -1.745247
H -3.736866 -1.236174 -1.000046
H -2.008008 0.109369 -2.126298
H -2.283625 1.516320 -1.075076
H 2.832872 -0.027635 2.656279
H 3.871637 1.170819 2.209701
H -5.643320 0.421386 -0.957041
H -4.721421 0.642324 -2.303897
H 5.563792 -0.976106 -1.454455
H -5.133250 -0.346660 2.233651


%chk=000193401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193401

0 1
S 0.200293 -0.819361 -0.408932
S -1.065796 0.442109 0.998536
O 4.075493 -1.097133 -1.469191
O 5.634637 0.252108 -0.405719
O -5.432546 -1.080181 0.392384
O -4.314117 0.395397 1.793696
N 4.027754 0.395040 1.842883
N -4.246127 0.337922 -1.689851
C 2.358839 1.034785 0.022728
C 3.385707 -0.013739 0.593178
C 1.408024 0.504102 -1.058693
C -3.450438 -0.044492 -0.504286
C -2.388374 1.032712 -0.221949
C 4.490986 -0.253292 -0.428830
C -4.397216 -0.180079 0.691787
H 1.754803 1.396691 0.877780
H 2.912394 1.912299 -0.369680
H 2.835824 -0.963621 0.735258
H 1.946557 -0.022197 -1.867006
H 0.801778 1.315763 -1.494302
H -2.933051 -1.029540 -0.611764
H -1.878135 1.324702 -1.153568
H -2.840874 1.924680 0.241919
H 3.397183 0.687012 2.589838
H 4.871230 0.962255 1.731548
H -5.124386 -0.182594 -1.779361
H -3.701458 0.348496 -2.557337
H 4.825273 -1.208776 -2.115755
H -6.041658 -1.158570 1.175689


