%chk=000277896.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277896

0 1
S 2.379513 1.287110 1.001525
O 2.245448 2.522833 0.273832
O 3.013047 1.297333 2.307456
N 0.792088 0.683213 1.402132
N 0.000283 0.446247 0.317848
C -3.301804 0.770242 -0.875366
C -2.065086 -0.137449 -0.776053
C -4.320247 0.461865 0.188743
C 3.076666 0.073481 0.011638
C 4.239511 -1.902449 -1.602426
C 2.728757 -0.021154 -1.341741
C 4.004193 -0.822955 0.556851
C -1.262941 0.166399 0.461128
C -5.149732 -0.664184 0.065676
C -4.447613 1.294691 1.310802
C 3.306254 -1.002255 -2.146980
C 4.585483 -1.805852 -0.243016
C -6.093932 -0.950969 1.054434
C -5.394643 1.003605 2.296600
C 4.856829 -2.946164 -2.471225
C -6.218925 -0.118834 2.171858
H -3.759666 0.656684 -1.880101
H -2.985099 1.833266 -0.822052
H -1.447221 -0.018772 -1.691753
H -2.369937 -1.205293 -0.750679
H 2.000364 0.676980 -1.770893
H 4.279401 -0.748744 1.616447
H -1.825990 0.125035 1.401749
H -5.058502 -1.314669 -0.801316
H -3.811296 2.171626 1.413907
H 3.034299 -1.070123 -3.198421
H 5.307744 -2.496758 0.187325
H 0.404711 0.751363 2.353538
H -6.735466 -1.824941 0.953910
H -5.490771 1.654924 3.163965
H 5.503368 -3.640322 -1.917502
H 4.092394 -3.554515 -2.977469
H 5.476649 -2.490237 -3.258925
H -6.955629 -0.343356 2.939756


%chk=000277896-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277896

0 1
S 2.207708 1.131978 0.916665
O 1.898058 2.449229 0.016282
O 2.847626 1.239214 2.409394
N 0.612369 0.115093 1.256962
N -0.220372 0.082337 0.156786
C -3.586546 0.776892 -0.884199
C -2.401886 -0.243489 -0.896227
C -4.552775 0.572725 0.276176
C 3.189559 -0.082816 -0.118253
C 4.691577 -1.870004 -1.656602
C 3.109837 0.019508 -1.516038
C 3.982424 -1.026333 0.551155
C -1.508744 -0.117340 0.311125
C -5.429047 -0.544856 0.294200
C -4.590737 1.475540 1.369744
C 3.872261 -0.889816 -2.279547
C 4.737061 -1.922363 -0.238515
C -6.315953 -0.755962 1.372801
C -5.477947 1.269473 2.452109
C 5.516242 -2.827058 -2.497839
C -6.342955 0.151423 2.458189
H -4.126350 0.667613 -1.845000
H -3.171902 1.801268 -0.860983
H -1.788849 -0.098491 -1.803333
H -2.823144 -1.269067 -0.937403
H 2.483908 0.786655 -1.981557
H 4.017921 -1.048065 1.644959
H -1.977223 -0.223633 1.309286
H -5.423447 -1.248920 -0.548073
H -3.928021 2.350041 1.368148
H 3.829409 -0.838695 -3.373740
H 5.368239 -2.669864 0.254862
H 0.242798 0.457231 2.173328
H -6.988386 -1.621457 1.365939
H -5.495769 1.981108 3.285477
H 5.947141 -3.638401 -1.887424
H 4.907023 -3.286907 -3.296875
H 6.353883 -2.298373 -2.991343
H -7.032490 -0.008517 3.294564


