%chk=000195943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195943

1 1
S 0.085348 1.811041 1.327815
O 3.477955 -1.428807 0.300218
O 1.646401 -1.806020 -0.943896
O -1.649600 1.951744 -0.624597
N -1.632249 -1.609848 -0.094423
C -1.102994 -0.605644 0.946352
C 0.185966 0.136348 0.575039
C -3.121080 -1.782594 0.148666
C -1.430175 -1.115582 -1.507394
C -0.964165 -2.954885 0.067605
C 1.476877 -0.479184 1.099795
C 2.157371 -1.297171 0.035911
C -1.086732 2.632249 0.185359
C -1.179656 4.071314 0.457161
H -0.983982 -1.134741 1.921697
H -1.922728 0.144547 1.114484
H 0.261793 0.282769 -0.538410
H -3.335104 -2.119338 1.179255
H -3.673587 -0.837497 -0.021551
H -3.561296 -2.533777 -0.535185
H -1.970669 -1.736967 -2.243265
H -1.782455 -0.067014 -1.627970
H -0.353244 -1.148271 -1.797207
H 0.111325 -2.910545 -0.220828
H -1.027422 -3.331322 1.101942
H -1.417659 -3.719493 -0.591810
H 2.202933 0.302263 1.461265
H 1.323682 -1.101453 2.011445
H -0.252672 4.614226 0.182190
H -1.363035 4.315178 1.520414
H -1.995696 4.548382 -0.121748
H 3.975347 -1.964207 -0.393429


%chk=000195943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195943

1 1
S 0.089328 1.844417 1.491239
O 3.530900 -1.540054 0.378262
O 1.758040 -1.588876 -1.117872
O -1.514171 2.081378 -0.724459
N -1.650688 -1.649285 -0.116308
C -1.169560 -0.546642 0.880413
C 0.188132 0.144873 0.608609
C -3.142315 -1.857194 0.157275
C -1.474825 -1.193482 -1.571160
C -0.926969 -2.974583 0.102132
C 1.477315 -0.550847 1.111221
C 2.233370 -1.268078 0.000578
C -1.015419 2.713051 0.232822
C -1.177607 4.184801 0.508764
H -1.186128 -1.008746 1.883767
H -1.964137 0.212965 0.828952
H 0.273616 0.404176 -0.459138
H -3.289293 -2.081123 1.225401
H -3.687994 -0.941066 -0.114556
H -3.503164 -2.698940 -0.453036
H -2.059039 -1.870216 -2.213980
H -1.839461 -0.158774 -1.663661
H -0.408173 -1.252416 -1.833679
H 0.137333 -2.843032 -0.127919
H -1.075254 -3.299836 1.143680
H -1.351679 -3.723614 -0.584296
H 2.174356 0.181501 1.555802
H 1.267407 -1.278643 1.918879
H -0.433426 4.744540 -0.090167
H -1.013368 4.432900 1.569707
H -2.179013 4.518939 0.190870
H 4.030682 -2.012393 -0.343242


