%chk=000274067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274067

0 1
S -1.324807 0.749143 0.600485
O -0.809241 0.843515 1.956692
O -2.766263 0.751856 0.413730
N -0.711610 2.077094 -0.340000
C -0.586866 -0.701223 -0.169740
C -1.238454 -0.918729 -1.552278
C -1.032022 -1.945214 0.643092
C -2.559667 -1.661429 -1.283145
C -2.377425 -2.406256 0.053074
C 0.911067 -0.547014 -0.174001
C 1.636139 -0.362122 -1.360378
C 1.608474 -0.585839 1.049077
C -1.750727 3.057341 -0.749887
C 0.481217 2.735841 0.252282
C 3.029383 -0.238616 -1.328085
C 2.997727 -0.463589 1.077099
C 3.714631 -0.293843 -0.112714
H -0.579473 -1.546085 -2.184153
H -1.395203 0.021367 -2.108201
H -1.101932 -1.745223 1.727559
H -0.272954 -2.744287 0.534875
H -2.811045 -2.347888 -2.105533
H -3.397424 -0.938252 -1.200320
H -3.210844 -2.169913 0.740378
H -2.390445 -3.498912 -0.089672
H 1.123329 -0.303779 -2.319510
H 1.057492 -0.684825 1.990028
H -2.659990 2.528549 -1.096192
H -1.369352 3.651860 -1.597294
H -2.055373 3.752357 0.049479
H 1.316899 2.012898 0.294705
H 0.317932 3.127553 1.271599
H 0.811900 3.569656 -0.388491
H 3.579056 -0.098732 -2.257635
H 3.524003 -0.498240 2.030319
H 4.798570 -0.202823 -0.089444


%chk=000274067-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274067

0 1
S -1.540514 0.922566 0.371123
O -1.552257 0.938752 2.014783
O -2.970081 1.085505 -0.425202
N -0.422571 2.355422 -0.323644
C -0.588421 -0.991367 -0.293278
C -1.364979 -1.284786 -1.589987
C -1.138936 -1.911391 0.806722
C -2.337655 -2.450094 -1.234249
C -2.539213 -2.328382 0.297951
C 0.866152 -0.679072 -0.322206
C 1.475190 -0.117412 -1.481068
C 1.683300 -0.928850 0.818821
C -1.289160 3.461093 -0.811869
C 0.531536 2.776416 0.736211
C 2.856342 0.159188 -1.507495
C 3.065219 -0.650302 0.792004
C 3.658835 -0.108167 -0.372423
H -0.676954 -1.541610 -2.414235
H -1.954515 -0.400843 -1.905041
H -1.153309 -1.427325 1.800781
H -0.474431 -2.798085 0.869160
H -1.869550 -3.423359 -1.477781
H -3.285544 -2.379330 -1.793785
H -3.277183 -1.537027 0.522961
H -2.890582 -3.265923 0.761762
H 0.859848 0.118719 -2.354709
H 1.235907 -1.344494 1.726855
H -2.160402 3.034030 -1.336332
H -0.690017 4.047914 -1.533127
H -1.652771 4.133017 -0.005289
H 1.138066 1.917854 1.063943
H 0.038696 3.228113 1.622357
H 1.206765 3.524497 0.280133
H 3.308079 0.588720 -2.408280
H 3.678705 -0.854095 1.676453
H 4.733108 0.106304 -0.394220


