%chk=000192597.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192597

0 1
S -1.612308 0.282707 1.151869
O -3.441730 1.833604 -1.189589
O -1.507898 -2.181903 -0.263792
O 1.565829 2.522445 0.833262
O 4.565163 -0.916934 0.567222
N 0.801716 0.523708 -0.053541
N 3.079421 0.785943 0.692138
C -2.990839 -0.241562 0.062160
C -2.775970 0.576195 -1.238299
C -1.269457 0.779893 -1.477582
C -0.561933 1.068384 -0.159471
C -2.869262 -1.757181 -0.178732
C -4.298371 0.085302 0.752756
C 1.097394 -0.799335 -0.436582
C 1.809150 1.371181 0.525598
C 2.332549 -1.335754 -0.272564
C 3.429696 -0.567735 0.333864
C 2.661549 -2.722893 -0.705655
H -3.269120 0.094131 -2.116011
H -0.858915 -0.122430 -1.981399
H -1.114908 1.612933 -2.196187
H -0.521123 2.174175 0.063013
H -3.286757 -2.053418 -1.161893
H -3.380071 -2.337907 0.612538
H -4.425935 1.167933 0.911430
H -5.161231 -0.230635 0.147970
H -4.389248 -0.391863 1.737401
H -3.119828 2.388846 -0.445653
H 0.261945 -1.371029 -0.887345
H -1.098106 -2.199182 0.636805
H 3.810706 1.379110 1.113741
H 3.103288 -2.726487 -1.714414
H 1.783917 -3.381643 -0.722196
H 3.407288 -3.184298 -0.035864


%chk=000192597-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192597

0 1
S -1.686372 0.299921 1.301336
O -3.244804 2.069303 -0.976253
O -1.643197 -2.288017 -0.287765
O 1.521760 2.571714 0.787560
O 4.747256 -0.778684 0.363652
N 0.837702 0.473072 -0.063145
N 3.092737 0.856476 0.545747
C -3.095874 -0.214131 0.075214
C -2.797971 0.683485 -1.168490
C -1.286093 0.626562 -1.456828
C -0.540665 0.958888 -0.147581
C -3.000892 -1.743978 -0.236896
C -4.467373 0.079403 0.707579
C 1.191134 -0.841997 -0.401546
C 1.803433 1.388260 0.452997
C 2.467433 -1.339986 -0.291346
C 3.533027 -0.459902 0.213200
C 2.834517 -2.755032 -0.664179
H -3.386531 0.334027 -2.034869
H -1.026950 -0.382000 -1.819452
H -1.024266 1.365260 -2.234226
H -0.478430 2.043114 0.032019
H -3.432086 -1.947486 -1.233602
H -3.597076 -2.293681 0.519506
H -4.622611 1.157482 0.864764
H -5.271254 -0.278158 0.034494
H -4.577376 -0.440060 1.675775
H -2.874552 2.403992 -0.115657
H 0.371316 -1.466336 -0.766487
H -1.230779 -2.088113 0.598499
H 3.807859 1.497667 0.904603
H 3.601217 -2.763315 -1.460014
H 1.953864 -3.320505 -1.012717
H 3.278500 -3.282943 0.199103


