%chk=000293089.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293089

0 1
S 1.368223 1.557219 -0.155863
O 2.306629 2.207625 -1.054784
O 0.916633 2.255495 1.016930
N 0.031222 1.329191 -1.256604
N -1.171663 0.021802 0.283685
C 1.945207 -0.013442 0.232652
C -1.162895 0.674095 -0.924464
C 2.877909 -0.635096 -0.608256
C 1.505308 -0.659336 1.392381
C -2.281342 0.669830 -1.798536
C -3.456503 -0.682782 -0.163431
C -3.423308 -0.014564 -1.401817
C 3.364950 -1.904428 -0.292413
C 1.994508 -1.932031 1.710209
C -2.305007 -0.634258 0.642101
C 2.920202 -2.552624 0.867615
C -4.678935 -1.412339 0.278572
H 0.049707 1.818604 -2.160819
H 3.234255 -0.121226 -1.508166
H 0.775126 -0.171164 2.051058
H -2.246293 1.192263 -2.748941
H -4.299483 -0.032662 -2.051228
H 4.090159 -2.388541 -0.943979
H 1.651404 -2.434695 2.612699
H -2.268925 -1.133612 1.617720
H 3.300843 -3.544889 1.113290
H -4.989349 -2.163607 -0.461727
H -4.535752 -1.940840 1.230278
H -5.524029 -0.722089 0.419836


%chk=000293089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293089

0 1
S 1.260055 1.358880 -0.274336
O 2.232162 2.189533 -1.285780
O 0.617300 2.069965 1.031604
N -0.061210 0.778654 -1.485491
N -1.403913 -0.284566 0.141291
C 2.160423 -0.225318 0.224428
C -1.338033 0.399644 -1.037845
C 3.371323 -0.486402 -0.434839
C 1.619504 -1.020143 1.245506
C -2.494426 0.669216 -1.826984
C -3.833093 -0.530972 -0.156503
C -3.735663 0.181351 -1.382981
C 4.089057 -1.638334 -0.036834
C 2.356844 -2.165015 1.627154
C -2.625566 -0.717567 0.559397
C 3.582549 -2.471294 0.988549
C -5.155285 -1.051001 0.369560
H 0.004568 1.397700 -2.307109
H 3.737190 0.193687 -1.210593
H 0.655855 -0.762419 1.693784
H -2.413438 1.238502 -2.758707
H -4.635753 0.369026 -1.980277
H 5.039612 -1.878350 -0.524198
H 1.971355 -2.814699 2.419661
H -2.634890 -1.244030 1.521975
H 4.145858 -3.360245 1.292863
H -5.627104 -1.752516 -0.343697
H -5.023096 -1.584107 1.326926
H -5.873387 -0.227282 0.541474


