%chk=000259008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259008

0 1
S -1.544697 -0.616073 -0.935415
O 0.464688 -0.948702 0.514110
O -4.924739 -0.406261 1.484598
O -2.776349 0.199244 1.694357
O 0.021400 1.278997 0.177080
N -4.852586 1.674500 -0.488661
C -3.968375 0.472869 -0.482697
C -2.635600 0.819028 -1.143948
C 2.845172 -0.462278 0.422258
C 1.666594 -0.688673 1.322045
C -3.746318 0.115616 0.990308
C 3.720937 -1.516721 0.127544
C 3.073606 0.809891 -0.124138
C 4.826293 -1.294851 -0.699219
C 4.178279 1.025841 -0.950967
C -0.216506 0.114190 0.032081
C 5.056937 -0.024798 -1.237077
H -4.434820 -0.422765 -0.983063
H -2.750105 1.036615 -2.222290
H -2.185417 1.736881 -0.688758
H 1.722473 -1.627103 1.906353
H 1.464850 0.166001 1.994662
H 3.540474 -2.509804 0.536125
H 2.377329 1.626085 0.089639
H -5.764584 1.448051 -0.093139
H -4.996937 2.014564 -1.434581
H 5.506437 -2.114030 -0.926209
H 4.353496 2.013759 -1.374332
H 5.918381 0.145975 -1.880483
H -4.865811 -0.649045 2.446517


%chk=000259008-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259008

0 1
S -1.597508 -0.919677 -0.896578
O 0.592370 -1.285076 0.483767
O -5.369375 0.393388 1.587451
O -3.062132 0.339556 1.841928
O -0.074343 0.964735 0.450374
N -4.952654 1.516514 -0.880073
C -4.073298 0.416482 -0.441585
C -2.661461 0.639484 -1.020898
C 2.982610 -0.529414 0.393105
C 1.829137 -0.917711 1.287697
C -4.052489 0.385538 1.090212
C 3.857781 -1.521778 -0.118238
C 3.207644 0.831379 0.059178
C 4.938793 -1.163113 -0.953143
C 4.289848 1.191121 -0.773888
C -0.233388 -0.230911 0.137207
C 5.157547 0.195582 -1.281283
H -4.435295 -0.596478 -0.753128
H -2.732715 0.891953 -2.091171
H -2.123300 1.440634 -0.488630
H 2.023099 -1.849340 1.840876
H 1.544992 -0.105687 1.977996
H 3.687531 -2.575298 0.135467
H 2.523265 1.596473 0.442070
H -5.824255 1.589785 -0.348083
H -5.086158 1.565143 -1.893492
H 5.609578 -1.936565 -1.343339
H 4.456557 2.244036 -1.026781
H 5.997908 0.475927 -1.926436
H -5.345788 0.370323 2.582116


