%chk=000253343.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253343

0 1
S 0.001952 2.659802 -0.000132
O 0.164638 3.387240 -1.251752
O -0.159160 3.387614 1.251469
N -4.702746 -0.923285 -0.640549
N 4.698963 -0.933336 0.640188
N -6.042500 -2.821874 -0.467289
N 6.034495 -2.834933 0.467565
N -6.641336 -3.558806 0.618662
N 6.630728 -3.574496 -0.618029
C -1.354325 1.589215 -0.169462
C 1.355888 1.586273 0.169206
C -1.719431 1.116432 -1.435057
C 1.719816 1.112479 1.434758
C -2.103627 1.230001 0.954119
C 2.104568 1.225650 -0.954345
C -2.802794 0.253369 -1.581438
C 2.801311 0.247075 1.581131
C -3.190263 0.364124 0.832406
C 3.189333 0.357435 -0.832646
C -3.541442 -0.126813 -0.441728
C 3.539308 -0.134461 0.441453
C -4.914931 -2.048149 -0.020462
C 4.908386 -2.059089 0.020778
H -1.159051 1.435606 -2.321162
H 1.160001 1.432678 2.320849
H -1.843618 1.637102 1.938740
H 1.845541 1.633469 -1.938930
H -3.099082 -0.111568 -2.564288
H 3.096683 -0.118665 2.563955
H -3.779431 0.097510 1.706471
H 3.778038 0.089686 -1.706677
H -4.278676 -2.538093 0.736352
H 4.270664 -2.548127 -0.735394
H -6.751364 -2.241955 -0.957405
H 6.745097 -2.256173 0.956508
H -7.556123 -3.904949 0.303979
H -6.067913 -4.399876 0.773911
H 7.544973 -3.922396 -0.303712
H 6.055230 -4.414414 -0.771842


%chk=000253343-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253343

0 1
S 0.001924 2.572965 -0.000260
O 0.235594 3.351386 -1.426246
O -0.229873 3.352255 1.425554
N -4.884077 -0.972734 -0.862495
N 4.879768 -0.983770 0.862676
N -6.469872 -2.569312 -0.229143
N 6.462081 -2.583886 0.229545
N -6.842884 -3.627561 0.609463
N 6.832918 -3.642866 -0.609105
C -1.487919 1.438622 -0.240918
C 1.489084 1.435154 0.240622
C -1.830078 1.052008 -1.548939
C 1.830303 1.047933 1.548708
C -2.250059 1.092365 0.886334
C 2.250484 1.087023 -0.886551
C -2.966564 0.240921 -1.725547
C 2.964941 0.234296 1.725476
C -3.384284 0.277166 0.698975
C 3.382856 0.269293 -0.699030
C -3.744971 -0.179489 -0.607007
C 3.742457 -0.188001 0.607029
C -5.276793 -1.900581 -0.026757
C 5.270505 -1.912524 0.027022
H -1.238185 1.406575 -2.399236
H 1.239178 1.403957 2.398930
H -1.977903 1.484759 1.872053
H 1.979241 1.479897 -1.872331
H -3.280927 -0.079106 -2.723376
H 3.278531 -0.086315 2.723361
H -4.018742 0.025000 1.556327
H 4.016780 0.015582 -1.556323
H -4.730942 -2.259253 0.864281
H 4.723950 -2.270020 -0.864058
H -7.038196 -2.291297 -1.038979
H 7.030958 -2.307098 1.039411
H -7.654047 -3.445680 1.204478
H -6.794931 -4.559245 0.190105
H 7.644504 -3.462651 -1.204050
H 6.782992 -4.574469 -0.189797


