%chk=000286924.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286924

0 1
S -0.315674 1.017852 -1.043410
O -1.052242 0.369410 0.346764
O -0.493239 2.440909 -0.987810
O -0.775200 0.241681 -2.159751
O 5.708792 -1.571060 0.025155
O 5.957527 0.327939 1.035633
N 5.310425 -0.481191 0.395394
C -2.524742 -2.038337 0.228369
C -3.192591 -0.700849 0.472738
C -2.433245 0.485530 0.469793
C -3.110213 -3.145404 1.112072
C -2.633518 -2.390766 -1.260216
C -4.572780 -0.571071 0.677999
C -2.995831 1.752855 0.659113
C 1.315577 0.587818 -0.632595
C -5.157504 0.684046 0.874886
C -4.373731 1.842854 0.864896
C 1.824137 -0.648819 -1.039853
C 2.099330 1.480571 0.103378
C 3.134608 -1.005713 -0.706897
C 3.411826 1.136708 0.443555
C 3.910659 -0.105522 0.033557
H -1.436888 -1.935223 0.489081
H -3.111069 -2.852086 2.168125
H -2.523969 -4.066744 1.024447
H -4.140913 -3.392247 0.835355
H -3.676312 -2.472088 -1.584618
H -2.142968 -3.342545 -1.483166
H -2.160802 -1.617118 -1.887157
H -5.199780 -1.463024 0.678853
H -2.368257 2.645568 0.636159
H -6.232214 0.759067 1.032828
H -4.835603 2.817844 1.014676
H 1.204669 -1.340971 -1.625422
H 1.695664 2.453814 0.412495
H 3.553490 -1.970748 -1.015776
H 4.043780 1.821959 1.020952


%chk=000286924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286924

0 1
S -0.203048 0.708603 -1.289517
O -1.052586 0.181169 0.522354
O -0.454234 2.298504 -1.542248
O -0.509223 -0.377423 -2.467862
O 6.109447 -1.242123 0.371731
O 6.135156 0.882796 1.202411
N 5.556690 -0.099991 0.600832
C -2.808781 -2.107865 0.015707
C -3.315929 -0.731717 0.437775
C -2.412109 0.372104 0.632480
C -3.273526 -3.216324 0.997843
C -3.243904 -2.433012 -1.441161
C -4.691945 -0.484391 0.656867
C -2.892106 1.670186 0.990488
C 1.569408 0.460673 -0.708349
C -5.166577 0.795669 1.023912
C -4.265296 1.879697 1.191310
C 2.175881 -0.781892 -0.958358
C 2.202595 1.528444 -0.049923
C 3.504857 -0.966470 -0.525206
C 3.531323 1.342227 0.382616
C 4.152223 0.097269 0.140152
H -1.704394 -2.073850 0.036306
H -2.962661 -2.992975 2.034199
H -2.832197 -4.186832 0.706007
H -4.373131 -3.334751 0.987659
H -4.345652 -2.430834 -1.540571
H -2.878238 -3.436147 -1.728767
H -2.824631 -1.699368 -2.151584
H -5.408296 -1.304363 0.532584
H -2.163737 2.479149 1.105429
H -6.240388 0.953128 1.175181
H -4.638543 2.870109 1.471270
H 1.631600 -1.567652 -1.490878
H 1.680056 2.477602 0.100990
H 4.038640 -1.905545 -0.690214
H 4.084454 2.131093 0.898137


