%chk=000299907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299907

0 1
S -4.327482 -1.831259 0.016393
F -2.848410 3.659588 1.340743
O 1.176138 1.879835 1.391229
O 3.407093 -1.249009 -1.517614
O 5.490500 2.487920 0.042070
N 0.041205 -2.004797 -0.501429
N 3.310502 2.165044 0.720923
N 4.410565 0.602572 -0.731793
C 2.022424 0.115630 -0.045432
C 0.847889 0.267748 -1.043994
C 1.723972 -1.002940 0.985132
C 0.397666 -1.079906 -1.626073
C 1.262300 -2.305677 0.311573
C 2.095335 1.430483 0.744272
C 3.282881 -0.264146 -0.825208
C -0.623221 -3.249130 -1.010216
C -2.127446 -2.962275 -1.195160
C 4.489746 1.808953 0.012367
C -2.855327 -2.891793 0.141153
C -3.789792 -0.202303 0.408849
C -2.467576 0.123171 0.717550
C -4.799404 0.770592 0.406168
C -2.134055 1.441682 1.043812
C -4.484068 2.093732 0.721206
C -3.153881 2.396057 1.035939
H 1.119418 0.960495 -1.862211
H -0.014991 0.733611 -0.511016
H 0.916504 -0.646599 1.666838
H 2.609816 -1.196439 1.617615
H 1.191588 -1.494432 -2.290322
H -0.508003 -0.921426 -2.253482
H 0.997504 -3.048180 1.095094
H 2.091881 -2.742996 -0.291207
H -0.188736 -3.613315 -1.966059
H -0.485734 -4.073418 -0.278000
H -2.252845 -2.014291 -1.761927
H -2.574608 -3.747030 -1.836877
H 3.346195 3.046848 1.261621
H 5.259447 0.333971 -1.259287
H -2.184467 -2.522149 0.945028
H -3.216575 -3.887288 0.463956
H -1.679441 -0.640771 0.703217
H -5.830234 0.506602 0.162705
H -1.105523 1.709779 1.305479
H -5.253753 2.863557 0.724474


%chk=000299907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299907

0 1
S -4.422496 -2.038186 0.453488
F -3.232721 3.864024 1.033388
O 1.170789 2.094724 0.997307
O 3.510496 -0.984769 -1.909651
O 5.809852 1.964299 0.837669
N 0.109989 -1.988089 -0.610809
N 3.472649 1.964020 0.928925
N 4.610175 0.430447 -0.458752
C 2.122334 0.190350 -0.241952
C 0.927631 0.288620 -1.242893
C 1.830918 -0.953668 0.819435
C 0.400698 -1.069116 -1.743361
C 1.345514 -2.257904 0.161996
C 2.194824 1.494563 0.580012
C 3.431729 -0.163688 -0.958836
C -0.629829 -3.202050 -1.050116
C -2.154515 -2.932656 -1.090467
C 4.712166 1.481543 0.469560
C -2.746823 -2.901538 0.331670
C -3.962119 -0.260059 0.583180
C -2.630944 0.224659 0.609526
C -5.045921 0.650758 0.692579
C -2.379268 1.609308 0.766939
C -4.806336 2.033015 0.838730
C -3.473575 2.480738 0.877246
H 1.225392 0.904213 -2.112112
H 0.115328 0.819366 -0.719922
H 1.029775 -0.579793 1.483430
H 2.732781 -1.141632 1.432956
H 1.129378 -1.527437 -2.449992
H -0.537412 -0.884865 -2.297887
H 1.110620 -2.981695 0.964576
H 2.153084 -2.702347 -0.468499
H -0.278600 -3.555935 -2.048423
H -0.420300 -4.020367 -0.333386
H -2.340094 -1.968251 -1.598062
H -2.664422 -3.708912 -1.692075
H 3.515433 2.775101 1.555295
H 5.495112 0.117076 -0.872189
H -2.058805 -2.407971 1.038432
H -2.949346 -3.920491 0.704952
H -1.775336 -0.452527 0.504115
H -6.077334 0.282275 0.671178
H -1.354905 1.994419 0.814272
H -5.630571 2.746729 0.926628


