%chk=000286359.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286359

0 1
S -2.125341 1.395257 -0.932756
O 4.500753 0.857791 0.088283
O -2.135297 1.655374 -2.356202
O -1.884600 2.505216 -0.020826
O 3.648467 0.958831 2.194344
N -0.908248 0.213765 -0.651360
C 3.194498 0.728053 -0.574510
C 2.611349 -0.644964 -0.283167
C 1.215734 -0.806021 -0.170462
C 2.288968 1.855842 -0.132820
C 3.574518 0.873660 -2.047217
C 0.323433 0.383717 -0.307503
C 0.968877 1.693253 -0.029052
C 3.453286 -1.754158 -0.156756
C 0.681926 -2.079584 0.072869
C 2.913582 -3.020316 0.090988
C 1.530295 -3.182934 0.205243
C -3.555839 0.563354 -0.460494
C 4.605678 0.939200 1.464536
C -4.155385 0.851139 0.772080
C -4.125261 -0.393712 -1.306563
C -5.890099 -0.781911 0.312275
C 6.054469 1.007693 1.807466
C -5.316053 0.184293 1.159415
C -5.287407 -1.066079 -0.924400
C -7.135345 -1.488414 0.732113
H 2.788654 2.800960 0.081549
H 2.692354 0.781871 -2.694784
H 4.042424 1.846680 -2.245649
H 4.296211 0.102799 -2.348807
H 0.297659 2.509585 0.284111
H 4.532251 -1.622719 -0.246476
H -0.401262 -2.203471 0.153730
H 3.574317 -3.880252 0.194836
H 1.110218 -4.169129 0.397205
H -3.713898 1.608821 1.431426
H -3.664518 -0.614897 -2.275598
H 6.272700 1.916143 2.390977
H 6.346940 0.146019 2.427943
H 6.700709 1.016250 0.915393
H -5.779866 0.412514 2.117003
H -5.725502 -1.808289 -1.588559
H -7.984473 -0.790052 0.793087
H -7.025256 -1.946416 1.726346
H -7.429220 -2.289662 0.040844


%chk=000286359-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286359

0 1
S -2.087825 1.448574 -0.677800
O 4.609818 0.936125 0.061977
O -2.097345 1.784708 -2.274130
O -1.888921 2.660529 0.406900
O 3.403080 1.032931 2.065768
N -0.869433 -0.018078 -0.397878
C 3.342728 0.667914 -0.733386
C 2.762505 -0.694518 -0.367856
C 1.358519 -0.878379 -0.234290
C 2.367100 1.803253 -0.541590
C 3.867629 0.680420 -2.192340
C 0.426992 0.284505 -0.370809
C 1.021877 1.630644 -0.436831
C 3.624427 -1.808922 -0.232854
C 0.842068 -2.174657 0.036586
C 3.106804 -3.089246 0.046292
C 1.707914 -3.272915 0.179229
C -3.676437 0.545921 -0.247251
C 4.491783 1.075341 1.457420
C -4.163321 0.645145 1.065775
C -4.333576 -0.160533 -1.264669
C -6.079315 -0.748923 0.377068
C 5.860817 1.254107 2.077533
C -5.375166 -0.011697 1.367509
C -5.545314 -0.810121 -0.936441
C -7.387879 -1.437775 0.720320
H 2.799679 2.811061 -0.576445
H 3.041422 0.469064 -2.891286
H 4.299171 1.666606 -2.433996
H 4.647839 -0.088946 -2.317789
H 0.354240 2.494621 -0.358567
H 4.705458 -1.662641 -0.332989
H -0.241296 -2.290512 0.134279
H 3.786477 -3.940726 0.160680
H 1.301819 -4.266841 0.394727
H -3.621816 1.233113 1.813714
H -3.922395 -0.183488 -2.278857
H 5.764912 1.786635 3.035751
H 6.303681 0.260657 2.276849
H 6.536562 1.796847 1.398570
H -5.780461 0.050324 2.384288
H -6.081229 -1.369144 -1.711778
H -8.173901 -0.697802 0.962840
H -7.276911 -2.093835 1.603129
H -7.755381 -2.054242 -0.117268


