%chk=000249879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249879

0 1
F 2.331008 -4.355827 2.781207
F 0.531845 -3.257851 2.894595
F 0.825461 -4.654702 1.335171
O 2.887486 2.121950 2.207956
O -1.485303 -0.071263 0.335260
O -0.555786 1.735993 -0.739910
N 2.263243 2.274431 0.009079
N -0.331286 1.421534 1.564360
C 3.608355 1.920026 -0.520884
C 3.532607 0.594500 -1.320279
C 3.016068 -0.530951 -0.471200
C 4.116392 3.056763 -1.410763
C 1.664641 -0.905211 -0.549582
C 3.867562 -1.199757 0.421779
C 2.013818 2.283157 1.373788
C 2.024810 -2.591605 1.151910
C 1.168538 -1.924556 0.261674
C 3.375929 -2.226137 1.230493
C 0.554854 2.577384 1.774884
C 1.458867 -3.680426 2.014742
C -0.762872 1.105897 0.285630
C -2.257514 -0.412560 -0.864695
C -3.557189 0.338149 -0.863415
C -4.720379 -0.263695 -0.363465
C -3.606686 1.647339 -1.365872
C -5.929645 0.437780 -0.378850
C -4.816867 2.344372 -1.377326
C -5.979457 1.739783 -0.886723
H 4.303700 1.784151 0.356327
H 4.542145 0.352977 -1.712966
H 2.901778 0.728471 -2.223137
H 3.471320 3.232851 -2.279099
H 5.125283 2.849501 -1.784850
H 4.166000 4.001029 -0.851110
H 1.495933 2.353073 -0.668690
H 0.996094 -0.388650 -1.239535
H 4.915123 -0.909847 0.498585
H 0.109147 -2.187209 0.206220
H 4.054384 -2.728653 1.922795
H 0.168506 3.465566 1.217928
H 0.539914 2.848501 2.859396
H -0.419550 0.743432 2.320765
H -2.374226 -1.504429 -0.723094
H -1.641815 -0.202486 -1.759919
H -4.685255 -1.273994 0.041734
H -2.692680 2.121222 -1.735579
H -6.833137 -0.030824 0.008141
H -4.854147 3.360265 -1.767711
H -6.922515 2.284034 -0.898165


%chk=000249879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249879

0 1
F 2.730636 -4.481791 2.802261
F 0.862141 -3.262871 3.191072
F 0.892933 -4.758957 1.493288
O 3.118808 2.096985 2.259175
O -1.611421 0.048857 0.351677
O -0.516084 1.895093 -0.635456
N 2.297383 2.203708 0.065613
N -0.199502 1.312391 1.610667
C 3.582867 1.909009 -0.594023
C 3.517171 0.544462 -1.352616
C 3.066779 -0.609810 -0.471938
C 3.991818 3.054036 -1.544590
C 1.834786 -1.269439 -0.712764
C 3.856087 -1.037325 0.627663
C 2.158317 2.225620 1.438400
C 2.187865 -2.718890 1.217098
C 1.389622 -2.313551 0.122740
C 3.425360 -2.080165 1.469235
C 0.700277 2.437120 1.918715
C 1.689127 -3.783124 2.145816
C -0.755246 1.152161 0.368583
C -2.353416 -0.187309 -0.937893
C -3.689719 0.520995 -0.946947
C -4.855894 -0.143928 -0.490299
C -3.791365 1.857843 -1.412766
C -6.105202 0.515184 -0.493943
C -5.039909 2.517723 -1.416092
C -6.199083 1.848258 -0.957586
H 4.320538 1.831626 0.225607
H 4.526563 0.345852 -1.764056
H 2.833168 0.650370 -2.217017
H 3.245107 3.191403 -2.349608
H 4.967149 2.839041 -2.018464
H 4.077647 4.003434 -0.988954
H 1.438450 2.284909 -0.502361
H 1.213573 -0.956392 -1.559868
H 4.809077 -0.540794 0.840205
H 0.435135 -2.811186 -0.074613
H 4.043059 -2.398357 2.314509
H 0.287481 3.352776 1.456750
H 0.734539 2.570757 3.010429
H -0.387247 0.599275 2.316709
H -2.468348 -1.282480 -0.954974
H -1.705612 0.151667 -1.764692
H -4.783508 -1.177212 -0.129028
H -2.887666 2.373822 -1.756638
H -7.001088 -0.007139 -0.140571
H -5.110708 3.549597 -1.777588
H -7.167941 2.360246 -0.963270


