%chk=000231725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231725

0 1
S -0.933134 -2.376295 -0.483567
O -1.606845 2.562395 -0.047450
O -5.328754 -0.069884 0.653996
N 1.631424 -1.669910 -1.125288
N 0.017765 0.087197 -0.505173
N -3.368016 -1.163674 0.143773
N -3.450238 1.256273 0.310750
C 3.433105 -0.079617 -0.276011
C 4.294937 -1.134073 0.445162
C 4.307835 1.099603 -0.746388
C 5.050114 -0.508241 1.626644
C 5.067075 1.723300 0.432663
C 5.912655 0.676827 1.171029
C 2.695272 -0.687920 -1.489303
C 0.415604 -1.149045 -0.680148
C -2.031264 -1.055356 -0.152698
C -1.359745 0.160754 -0.227357
C -2.037991 1.437201 -0.004566
C -4.144912 0.029157 0.394728
C -4.035943 -2.483962 0.205648
C -4.257795 2.477230 0.590224
H 2.670747 0.317859 0.441930
H 5.019186 -1.579200 -0.263465
H 3.665028 -1.965131 0.809101
H 3.674260 1.869488 -1.227874
H 5.025794 0.760064 -1.516022
H 4.328779 -0.170668 2.396099
H 5.684226 -1.271627 2.114286
H 5.713089 2.544391 0.069827
H 4.348107 2.188696 1.135245
H 6.408745 1.140186 2.043984
H 6.725060 0.317762 0.510840
H 3.401499 -1.227495 -2.159347
H 2.237122 0.125610 -2.100521
H 1.991403 -2.438301 -0.545414
H -3.591888 -3.113329 0.996378
H -3.966887 -3.006354 -0.764556
H -5.113121 -2.348336 0.443353
H -5.288106 2.359361 0.210415
H -3.791497 3.353194 0.100114
H -4.302496 2.667573 1.675861


%chk=000231725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231725

0 1
S -0.947782 -2.461223 -0.457175
O -1.625899 2.581205 -0.197301
O -5.375393 -0.087057 0.782957
N 1.634645 -1.552444 -1.183086
N -0.032090 0.096116 -0.663377
N -3.373833 -1.177289 0.220095
N -3.490255 1.219125 0.289069
C 3.444023 -0.005795 -0.274774
C 4.222142 -1.103466 0.493222
C 4.398963 1.127448 -0.729426
C 5.020729 -0.515511 1.681894
C 5.198755 1.715813 0.456641
C 5.972141 0.612062 1.216866
C 2.693128 -0.570351 -1.506103
C 0.387982 -1.141476 -0.795564
C -2.044171 -1.055204 -0.144406
C -1.385433 0.166358 -0.306783
C -2.104178 1.419016 -0.087533
C -4.157010 -0.010395 0.452126
C -4.017140 -2.497215 0.368022
C -4.314523 2.425729 0.534937
H 2.685537 0.436182 0.403902
H 4.928544 -1.601556 -0.207012
H 3.522802 -1.881678 0.859669
H 3.816732 1.927215 -1.228014
H 5.110283 0.726079 -1.483894
H 4.310720 -0.107482 2.430473
H 5.593252 -1.317362 2.187603
H 5.898188 2.493228 0.092765
H 4.497447 2.216964 1.154837
H 6.503357 1.046356 2.085839
H 6.747255 0.182648 0.547965
H 3.409020 -1.069047 -2.188636
H 2.214570 0.260726 -2.055220
H 1.865556 -2.543328 -1.147764
H -3.517914 -3.081921 1.161075
H -3.971812 -3.054437 -0.584628
H -5.067340 -2.322144 0.644453
H -5.173199 2.444179 -0.155961
H -3.667464 3.299471 0.371640
H -4.700138 2.416162 1.567509


