%chk=000277076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277076

0 1
S 3.269609 -1.412328 0.943255
F -1.602519 -0.819104 2.911475
O 0.158455 1.699172 -1.197941
O 2.251053 -0.058152 0.681424
O 1.840899 4.198041 -0.528702
O 4.523080 -1.058092 0.341696
O 2.515159 -2.529408 0.449502
O -2.736588 -0.284465 -2.312128
O -4.197187 -1.270498 1.918347
N -1.167613 -0.171113 -0.615080
N -3.473529 -0.779484 -0.185008
C 2.143166 0.436843 -0.660908
C 1.186740 -0.435427 -1.489366
C 1.439666 1.808459 -0.511903
C -0.129555 0.346352 -1.567438
C 2.174005 2.975676 -1.186669
C -2.492819 -0.396287 -1.126952
C -0.889601 -0.300858 0.754777
C -1.870653 -0.673544 1.614185
C 3.311124 -1.355469 2.665330
C -3.260797 -0.944371 1.231265
H 3.163829 0.503068 -1.098503
H 1.587186 -0.624221 -2.503930
H 1.064866 -1.451555 -1.046470
H 1.207410 2.041219 0.553387
H -0.591520 0.415821 -2.587171
H 1.922274 3.042988 -2.261782
H 3.272393 2.913487 -1.053167
H 0.148833 -0.098092 1.073925
H 0.893792 4.418260 -0.685292
H -4.423343 -0.949141 -0.551757
H 2.757662 -0.496015 3.090108
H 2.866269 -2.243103 3.150669
H 4.329551 -1.266657 3.083423


%chk=000277076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277076

0 1
S 3.188582 -1.553568 1.018134
F -1.632684 -1.336804 2.926846
O 0.155699 1.907071 -0.610792
O 2.167055 0.047637 0.863740
O 1.512719 4.271481 -1.393202
O 4.594792 -1.291899 0.259248
O 2.270291 -2.822236 0.613493
O -2.734110 0.045779 -2.298244
O -4.222825 -1.805748 1.740909
N -1.202306 -0.068561 -0.501563
N -3.414846 -0.874316 -0.255317
C 2.182399 0.589794 -0.515276
C 1.178893 -0.131850 -1.447962
C 1.628602 2.023295 -0.404751
C -0.165516 0.629716 -1.291696
C 2.194798 2.986336 -1.468772
C -2.474246 -0.272211 -1.107015
C -0.957712 -0.414693 0.827888
C -1.919879 -0.995921 1.603948
C 3.369371 -1.429930 2.901571
C -3.271092 -1.280104 1.109126
H 3.220678 0.561789 -0.896966
H 1.524463 -0.048783 -2.492920
H 1.086136 -1.203360 -1.208678
H 1.768740 2.450134 0.602524
H -0.647907 0.845591 -2.258344
H 2.099789 2.536409 -2.482003
H 3.258933 3.197913 -1.268616
H 0.044482 -0.200615 1.209592
H 0.535285 4.093599 -1.409445
H -4.336899 -1.039659 -0.672874
H 3.905739 -0.491623 3.090705
H 2.346401 -1.423631 3.300795
H 3.937473 -2.319032 3.208515


