%chk=000248885.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248885

0 1
S -1.633429 1.402013 -0.210152
O 3.418789 -0.369925 -1.334451
O -2.627318 2.317353 0.311261
O -0.907151 1.713605 -1.419013
N -0.523561 1.243313 1.101464
C 0.775517 0.675418 1.040023
C -2.320920 -0.176182 -0.341462
C 3.329642 -0.538897 0.996666
C 1.424645 0.480349 -0.194663
C 2.684286 -0.119951 -0.197695
C 1.400904 0.290105 2.240760
C 2.664168 -0.310059 2.200646
C -3.634651 -0.389376 0.091766
C -1.581200 -1.232486 -0.882224
C 4.668546 -1.195093 0.955693
C -4.208422 -1.659102 -0.013942
C -2.153311 -2.504017 -0.987333
C -3.466170 -2.716110 -0.552996
C 2.909334 0.127807 -2.597378
H -0.789397 1.633270 2.016287
H 0.983220 0.850762 -1.122703
H 0.914193 0.448851 3.196971
H 3.137557 -0.607123 3.137968
H -4.217129 0.440499 0.510773
H -0.553389 -1.072869 -1.225407
H 5.187390 -0.995240 0.004572
H 5.323329 -0.843448 1.762685
H 4.575772 -2.286146 1.047730
H -5.231269 -1.824513 0.321879
H -1.575990 -3.327317 -1.406233
H -3.912873 -3.708109 -0.635113
H 2.791234 1.215835 -2.560040
H 1.968261 -0.369053 -2.848710
H 3.709190 -0.160164 -3.290430


%chk=000248885-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248885

0 1
S -1.704021 1.394681 -0.670406
O 3.754702 -0.031410 -1.318118
O -2.903172 2.448818 -0.365147
O -0.910864 1.335820 -2.088109
N -0.325875 1.831969 0.680356
C 0.768931 0.929134 0.750724
C -2.372691 -0.349371 -0.325560
C 3.080465 -0.750647 0.857172
C 1.684462 0.912704 -0.338652
C 2.810237 0.067498 -0.286200
C 0.995910 0.096167 1.879273
C 2.158401 -0.704216 1.926853
C -3.539262 -0.457125 0.450622
C -1.678749 -1.447980 -0.859853
C 4.317211 -1.620172 0.893550
C -4.035636 -1.756099 0.707323
C -2.189274 -2.738439 -0.585593
C -3.359271 -2.889722 0.195849
C 3.531376 0.782199 -2.520211
H -0.877120 1.896631 1.557419
H 1.487164 1.571452 -1.186944
H 0.282857 0.090107 2.712427
H 2.349616 -1.324629 2.810027
H -4.051411 0.442246 0.808612
H -0.790458 -1.297894 -1.481170
H 5.234371 -1.009877 0.798076
H 4.372419 -2.194251 1.833959
H 4.331706 -2.327583 0.043948
H -4.949438 -1.879584 1.297841
H -1.675842 -3.618745 -0.985793
H -3.750550 -3.892392 0.399250
H 3.567135 1.862499 -2.282729
H 2.560246 0.540747 -2.992484
H 4.356224 0.521462 -3.199115


