%chk=000270313.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270313

0 1
S -5.561030 1.618048 -0.632152
O -0.044377 -0.182789 -1.455224
O 0.955756 0.314382 1.704408
O -5.746555 -0.538534 0.838437
O -7.534729 0.694750 0.660086
N -6.386721 0.402236 0.451203
C 1.035072 0.247839 -0.648580
C 1.280635 -1.855818 0.790085
C 3.190224 1.508505 -0.630321
C 1.077465 -0.388984 0.722559
C 1.921600 1.066441 -1.225908
C -1.312394 0.281324 -1.155452
C 1.258673 -2.665923 -0.356210
C 1.497345 -2.436925 2.052667
C 3.249080 2.001268 0.682603
C 4.359141 1.461071 -1.411240
C -1.615380 1.163849 -0.109475
C -2.294497 -0.227610 -2.030644
C -3.931368 1.059298 -0.802458
C -2.944908 1.544633 0.067933
C -3.613274 0.166541 -1.840823
C 1.456789 -4.043377 -0.239378
C 1.697574 -3.813733 2.163843
C 4.467673 2.437528 1.209606
C 5.573678 1.892011 -0.874658
C 1.677698 -4.616664 1.018014
C 5.630044 2.382222 0.435073
H 1.725994 1.437772 -2.241972
H 1.076424 -2.222975 -1.339272
H 1.504416 -1.798859 2.941425
H 2.342919 2.043348 1.294278
H 4.319704 1.081953 -2.431057
H -0.838543 1.535918 0.562270
H -2.009033 -0.915742 -2.824049
H -3.208101 2.222080 0.885560
H -4.396521 -0.218729 -2.499438
H 1.437313 -4.672159 -1.128481
H 1.865999 -4.262085 3.142192
H 4.508636 2.819982 2.229099
H 6.479338 1.848175 -1.478011
H 1.832725 -5.692494 1.105273
H 6.578413 2.720625 0.849291


%chk=000270313-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270313

0 1
S -5.485446 0.899553 -0.518353
O 0.377877 -0.030054 -1.538284
O 1.681978 0.263485 1.803629
O -4.944306 -1.346922 1.120177
O -7.114145 -0.624389 1.131574
N -5.897375 -0.586080 0.772433
C 1.393353 0.354910 -0.585708
C 0.858467 -1.766167 0.803347
C 3.599512 1.769055 -0.593492
C 1.330656 -0.345671 0.740649
C 2.333129 1.219166 -1.094565
C -0.972413 0.203676 -1.218723
C 0.911639 -2.646191 -0.312473
C 0.414490 -2.259933 2.060783
C 4.006288 1.819870 0.774326
C 4.477715 2.319157 -1.579768
C -1.388140 1.054974 -0.163950
C -1.915336 -0.437950 -2.059482
C -3.721602 0.606115 -0.776395
C -2.765743 1.246800 0.053276
C -3.286794 -0.236842 -1.835282
C 0.526609 -3.995218 -0.166974
C 0.014159 -3.602471 2.198079
C 5.257393 2.367759 1.123254
C 5.726023 2.864080 -1.224982
C 0.070341 -4.474589 1.083584
C 6.124474 2.886910 0.132820
H 2.111444 1.496966 -2.136802
H 1.259055 -2.279146 -1.282855
H 0.394793 -1.572876 2.913017
H 3.326016 1.453471 1.546960
H 4.174960 2.300803 -2.634350
H -0.655080 1.567236 0.465704
H -1.557897 -1.084894 -2.865431
H -3.104571 1.899022 0.864285
H -4.026938 -0.730379 -2.472717
H 0.580332 -4.672708 -1.025978
H -0.341479 -3.971839 3.165721
H 5.552318 2.401962 2.177862
H 6.384458 3.272218 -1.999394
H -0.239530 -5.520240 1.189695
H 7.092211 3.315769 0.415885


