%chk=000265216.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265216

0 1
S 1.706298 0.093584 -0.458478
S -0.773049 -0.852430 -1.681974
O -0.119449 -2.173495 -1.625153
O -0.913621 -0.247772 -2.992367
O -6.805178 0.862984 1.010173
N 0.106815 0.125068 -0.660548
N -6.104150 -1.335352 0.909590
C 1.894360 1.148875 1.020216
C 2.137791 -1.537077 0.222966
C 2.270684 2.506964 0.527597
C 3.615604 -1.605458 0.362928
C -2.321214 -0.961125 -0.923755
C 1.307444 3.319615 -0.093424
C 4.427711 -1.737604 -0.776618
C 3.582687 2.979785 0.686756
C 4.212708 -1.536944 1.633047
C -3.099203 0.183285 -0.725283
C -2.798995 -2.209794 -0.510765
C -4.830697 -1.163008 0.290380
C -4.351791 0.093930 -0.118099
C -4.047943 -2.325239 0.093398
C 1.656797 4.593119 -0.546606
C 5.817054 -1.788047 -0.644376
C 3.923952 4.256886 0.232131
C 5.603558 -1.590339 1.757378
C 2.963903 5.065359 -0.383397
C 6.408751 -1.711841 0.620976
C -7.030454 -0.306732 1.230283
C -8.294190 -0.817166 1.863065
H 2.653308 0.722043 1.702502
H 0.944893 1.186148 1.599224
H 1.744635 -2.313925 -0.492328
H 1.599343 -1.767801 1.159122
H 0.289267 2.947696 -0.232482
H 3.973970 -1.809046 -1.765337
H 4.337594 2.356116 1.161111
H 3.595436 -1.458205 2.525116
H -2.730150 1.163306 -1.046778
H -2.184732 -3.106666 -0.665491
H -4.954273 0.995988 0.034792
H -4.407686 -3.301618 0.404104
H 0.908242 5.218779 -1.031567
H 6.441363 -1.890211 -1.531636
H 4.942401 4.621052 0.357507
H 6.060843 -1.540640 2.744639
H 3.232328 6.058658 -0.737384
H 7.491498 -1.752376 0.720178
H -6.360058 -2.300550 1.132513
H -8.113156 -1.336572 2.813478
H -8.966040 0.030162 2.087473
H -8.852809 -1.495568 1.204004


%chk=000265216-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265216

0 1
S 1.912919 0.131456 -0.389094
S -0.705219 -0.587835 -1.559208
O -0.026719 -2.087305 -1.718569
O -0.878257 0.325508 -2.901711
O -7.451531 0.569142 0.153283
N 0.106805 0.274510 -0.119556
N -6.229325 -1.290544 0.907221
C 2.316916 1.344528 1.064121
C 2.338825 -1.608974 0.487429
C 2.422286 2.762178 0.577793
C 3.807114 -1.883020 0.465311
C -2.407026 -0.776161 -0.786204
C 1.253666 3.486122 0.220037
C 4.427932 -2.365045 -0.720863
C 3.690302 3.391675 0.479996
C 4.612538 -1.650200 1.614111
C -3.386529 0.184569 -1.080116
C -2.656693 -1.892206 0.029234
C -4.956275 -1.072407 0.311663
C -4.676184 0.041907 -0.526803
C -3.943796 -2.038113 0.576978
C 1.356926 4.822718 -0.219665
C 5.817308 -2.606223 -0.754888
C 3.790073 4.731530 0.044614
C 6.002747 -1.896057 1.580660
C 2.622943 5.449547 -0.304891
C 6.609515 -2.371870 0.394734
C -7.385941 -0.506350 0.815445
C -8.587040 -1.055619 1.582338
H 3.257841 0.959549 1.489757
H 1.466404 1.165372 1.743026
H 1.716322 -2.265089 -0.144837
H 1.897298 -1.497251 1.490550
H 0.280757 2.984442 0.268872
H 3.814077 -2.552023 -1.610004
H 4.596982 2.834173 0.746355
H 4.142982 -1.300510 2.542744
H -3.148328 1.017636 -1.749371
H -1.871857 -2.634439 0.204095
H -5.462532 0.769832 -0.731127
H -4.165925 -2.904776 1.212454
H 0.452980 5.374081 -0.500048
H 6.282964 -2.980145 -1.673246
H 4.771971 5.212464 -0.023531
H 6.610023 -1.723720 2.476177
H 2.699411 6.488119 -0.645472
H 7.687788 -2.563584 0.367592
H -6.305076 -2.136373 1.476378
H -8.372781 -1.969945 2.162575
H -8.957696 -0.276128 2.269371
H -9.399485 -1.272344 0.867089


