%chk=000207609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207609

0 1
S 5.617546 -0.499780 -0.040946
F 1.709689 2.680809 -0.315496
O -0.928163 -1.052627 1.411585
O -0.253255 2.466481 -1.499404
O 5.818182 -1.892202 -0.382939
O 6.323143 0.555300 -0.735380
N -0.249537 0.655975 -0.018890
N 6.064427 -0.354730 1.612562
C -2.606453 0.569934 0.548548
C -2.350328 1.664501 -0.520965
C -1.217227 -0.097756 0.739148
C -3.682803 -0.404911 0.101763
C -2.988128 1.172780 1.903634
C -0.865292 1.721416 -0.787216
C 1.158458 0.383469 -0.018251
C -3.522825 -1.792404 0.200199
C -4.894505 0.112817 -0.390042
C 2.112106 1.417773 -0.180407
C 1.628983 -0.930922 0.147251
C -4.547604 -2.650986 -0.212797
C -5.914859 -0.746960 -0.799850
C 3.920662 -0.154388 -0.034672
C 3.483262 1.161779 -0.203079
C 3.001187 -1.191439 0.138870
C -5.742474 -2.133140 -0.717061
H -2.723272 2.658265 -0.201570
H -2.882966 1.450226 -1.473496
H -3.072101 0.389885 2.673699
H -2.252589 1.904699 2.258793
H -3.962485 1.676093 1.859211
H -2.607041 -2.225353 0.611926
H -5.049171 1.189024 -0.448171
H 0.920744 -1.752196 0.297830
H -4.409195 -3.729394 -0.135825
H -6.848634 -0.337084 -1.183054
H 4.199413 1.979573 -0.357554
H 3.350694 -2.224874 0.257182
H -6.537620 -2.803122 -1.040140
H 6.672329 0.415327 1.882403
H 6.348403 -1.194956 2.111203


%chk=000207609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207609

0 1
S 5.784129 -0.280413 0.033934
F 1.514051 2.671371 0.665022
O -0.895691 -1.064453 1.345438
O -0.202729 2.407324 -1.731754
O 6.096090 -1.587377 -0.884488
O 6.492432 1.169594 -0.173839
N -0.240718 0.634834 -0.155749
N 6.097363 -0.747136 1.781616
C -2.587963 0.548904 0.392896
C -2.344447 1.558629 -0.769101
C -1.199352 -0.107489 0.598493
C -3.729213 -0.449335 0.106160
C -2.902552 1.304406 1.729851
C -0.837376 1.648869 -0.973080
C 1.167772 0.396878 -0.097180
C -3.714151 -1.784647 0.585263
C -4.882497 0.009188 -0.585185
C 2.048712 1.437149 0.284277
C 1.705709 -0.869949 -0.417480
C -4.814106 -2.641815 0.353739
C -5.983245 -0.845941 -0.810107
C 3.917548 -0.013081 0.000401
C 3.439320 1.263631 0.326738
C 3.097604 -1.091001 -0.366085
C -5.952205 -2.179975 -0.344286
H -2.748731 2.564628 -0.566467
H -2.787768 1.209489 -1.718605
H -2.948768 0.589827 2.568660
H -2.129416 2.062954 1.952548
H -3.880803 1.808410 1.644671
H -2.845492 -2.151127 1.139432
H -4.933695 1.042482 -0.948738
H 1.027816 -1.677749 -0.704688
H -4.780058 -3.672448 0.724437
H -6.861405 -0.470454 -1.347191
H 4.109465 2.087139 0.589902
H 3.535281 -2.056679 -0.634566
H -6.803443 -2.846856 -0.519841
H 6.790805 -0.087215 2.170665
H 6.402430 -1.733662 1.812889


