%chk=000290013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290013

0 1
S 1.463173 -0.354752 0.188302
O -1.524353 -1.086943 -0.940497
O -2.408783 -0.011681 0.921467
O 1.309398 -1.718617 0.644250
O 2.146339 -0.093476 -1.071338
O 4.400853 0.090801 2.548494
N 4.515357 0.264789 0.285977
C -0.113852 0.414955 0.155760
C -1.242161 -0.600791 0.369444
C 2.341511 0.559039 1.420593
C -1.998385 -2.456461 -1.031474
C -3.200302 0.868704 0.085691
C 3.824326 0.259144 1.489281
C -3.427568 -2.579545 -0.539628
C -2.839020 2.318364 0.364016
H -0.287070 0.912534 -0.831537
H -0.245529 1.235345 0.887780
H -1.011190 -1.407790 1.103133
H 2.229446 1.656924 1.298550
H 1.931926 0.362753 2.441894
H -1.901977 -2.637206 -2.119540
H -1.298750 -3.111397 -0.480454
H -3.075148 0.587624 -0.975546
H -4.226793 0.626002 0.421280
H -3.758518 -3.624010 -0.522688
H -3.536652 -2.176110 0.478564
H -4.123172 -2.017556 -1.174367
H -3.650568 2.991932 0.061752
H -2.666217 2.476636 1.437187
H -1.937918 2.635900 -0.168995
H 4.055154 0.284806 -0.627954
H 5.493742 0.010184 0.284204


%chk=000290013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290013

0 1
S 1.403293 -0.380359 0.260370
O -1.455104 -1.046579 -0.882935
O -2.684269 0.114340 0.876475
O 1.182758 -1.912367 0.787393
O 2.034956 -0.096871 -1.238913
O 4.828088 0.244229 2.385055
N 4.518591 -0.052726 0.081372
C -0.307396 0.582609 0.397175
C -1.416873 -0.470503 0.438363
C 2.599449 0.537120 1.525642
C -1.804698 -2.492483 -0.931728
C -3.327249 1.069463 -0.067512
C 4.090897 0.202926 1.355649
C -3.280029 -2.768930 -0.616044
C -3.135007 2.523206 0.383893
H -0.313858 1.203010 -0.511568
H -0.242251 1.165239 1.329503
H -1.202325 -1.236365 1.208872
H 2.411922 1.608934 1.341608
H 2.250104 0.223315 2.519885
H -1.553638 -2.780360 -1.965898
H -1.125840 -3.031184 -0.241484
H -2.943758 0.890815 -1.089274
H -4.397061 0.797311 -0.048173
H -3.479706 -3.853583 -0.704461
H -3.538727 -2.449244 0.407789
H -3.941862 -2.237075 -1.321994
H -3.735742 3.200342 -0.252362
H -3.464507 2.649230 1.429783
H -2.078950 2.840163 0.311985
H 3.840943 -0.093975 -0.702974
H 5.505148 -0.269548 -0.061890


