%chk=000261249.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261249

0 1
S -2.198139 -1.633668 -1.191179
P -0.658773 -1.530027 0.197144
O 0.390574 -0.676260 -0.773994
O -0.108310 -2.715400 0.871899
N -1.373738 -0.319699 1.237371
C -2.535599 0.279416 0.719919
C -3.048942 -0.259406 -0.485840
C 1.651138 -0.322212 -0.302730
C -3.198696 1.354886 1.338613
C 3.341460 1.388832 -0.350394
C 3.741686 -0.717887 0.809985
C 2.461116 -1.172708 0.450432
C 2.060193 0.955194 -0.710441
C -4.193524 0.263738 -1.074870
C 4.175492 0.554256 0.413695
C -4.349617 1.869691 0.740031
C -4.846654 1.335524 -0.456049
C 3.829557 2.734850 -0.776775
C 4.637948 -1.610670 1.604119
H -1.002040 -0.018595 2.143237
H -2.820553 1.778238 2.264557
H 2.135578 -2.174074 0.742591
H 1.389309 1.569373 -1.304255
H -4.581682 -0.152646 -2.005779
H 5.167723 0.898217 0.691714
H -4.869767 2.704296 1.212957
H -5.743767 1.754487 -0.906218
H 4.250536 3.300087 0.066378
H 4.623828 2.639896 -1.532669
H 3.038073 3.354249 -1.218967
H 5.474268 -1.073150 2.068311
H 4.093976 -2.125138 2.409733
H 5.070246 -2.394293 0.962470


%chk=000261249-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261249

0 1
S -2.380922 -1.716979 -1.262442
P -0.703160 -1.544105 0.271840
O 0.454720 -0.707032 -0.755861
O -0.102578 -2.761094 1.104488
N -1.550774 -0.346249 1.217270
C -2.707670 0.268751 0.690463
C -3.241620 -0.269357 -0.515760
C 1.758213 -0.320820 -0.301159
C -3.348792 1.369528 1.306971
C 3.474293 1.412920 -0.347522
C 3.885196 -0.737678 0.811992
C 2.588589 -1.182094 0.443478
C 2.178487 0.967099 -0.697151
C -4.400259 0.281254 -1.097188
C 4.309152 0.553201 0.414620
C -4.515720 1.912138 0.727884
C -5.041090 1.375036 -0.470019
C 3.965216 2.783190 -0.783491
C 4.805865 -1.655480 1.598421
H -1.218355 -0.103430 2.151244
H -2.936574 1.794417 2.228925
H 2.232629 -2.177177 0.730924
H 1.494368 1.596502 -1.275130
H -4.801897 -0.134609 -2.026827
H 5.311166 0.898222 0.699855
H -5.011224 2.760827 1.210977
H -5.942607 1.803032 -0.919269
H 4.451858 3.321506 0.050223
H 4.711960 2.696827 -1.596019
H 3.138369 3.410618 -1.158137
H 5.645676 -1.097763 2.047593
H 4.263461 -2.173910 2.409285
H 5.236922 -2.437894 0.944520


