%chk=000036683.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000036683

0 1
F 5.082984 0.918136 0.807231
F 4.461553 -0.467226 2.275561
F 5.011312 -1.143952 0.347037
O -4.304308 0.651022 -0.471650
O 1.463176 3.027877 -1.843616
O 0.286713 -3.114187 1.261051
O -0.284066 3.070489 -0.573407
O -0.880513 -2.564569 -0.469248
N -1.206990 0.284071 -0.539230
N 0.713145 2.531989 -1.020499
N -0.031942 -2.334211 0.377562
C -3.386681 0.590644 0.641681
C -4.203108 0.111872 1.855002
C -2.243609 -0.395736 0.289216
C -5.449931 -0.569884 1.265944
C -5.455371 -0.203145 -0.223237
C 0.128420 0.143433 -0.265690
C -1.717348 0.932475 -1.791074
C 1.083795 1.200217 -0.501131
C 0.685230 -1.052010 0.324723
C -0.938643 0.491434 -3.020635
C 2.429526 1.078549 -0.151597
C 2.015256 -1.112940 0.760331
C 2.899057 -0.056651 0.522976
C 4.321248 -0.174350 0.971315
H -3.018118 1.635254 0.737969
H -3.640150 -0.568914 2.514392
H -4.490308 0.974747 2.484823
H -1.797947 -0.774238 1.234181
H -2.661465 -1.276709 -0.262407
H -5.412013 -1.664362 1.409417
H -6.368695 -0.225715 1.772238
H -5.350530 -1.074494 -0.888686
H -6.315362 0.413845 -0.530405
H -1.724600 2.042324 -1.669150
H -2.798538 0.646023 -1.911201
H -1.417369 0.876230 -3.933066
H -0.907469 -0.603832 -3.115115
H 0.097636 0.848937 -3.039039
H 3.115693 1.906608 -0.393866
H 2.366232 -2.030353 1.264300


%chk=000036683-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036683

0 1
F 5.015695 1.204041 0.779016
F 4.522285 -0.411390 2.301779
F 5.105494 -0.987397 0.194764
O -4.288889 0.641362 -0.520733
O 1.380797 3.238308 -1.596890
O 0.386154 -3.153916 1.488774
O -0.622437 2.889933 -0.561920
O -0.726174 -2.760525 -0.462373
N -1.205352 0.065544 -0.640218
N 0.555217 2.498065 -0.929006
N 0.073062 -2.398082 0.486560
C -3.351264 0.482545 0.628539
C -4.219392 -0.014574 1.823300
C -2.238479 -0.528973 0.243459
C -5.509158 -0.563678 1.156554
C -5.671026 0.378851 -0.048919
C 0.125331 0.058468 -0.266766
C -1.689329 0.638816 -1.932480
C 1.027632 1.165557 -0.489511
C 0.745071 -1.076312 0.388979
C -0.745800 0.368149 -3.117675
C 2.390414 1.129030 -0.142195
C 2.081283 -1.083115 0.818116
C 2.917737 0.017035 0.536377
C 4.359943 -0.032821 0.943485
H -2.891323 1.467781 0.833910
H -3.706083 -0.776688 2.434420
H -4.464456 0.836803 2.483103
H -1.747601 -0.847471 1.179174
H -2.695265 -1.418561 -0.229974
H -5.360303 -1.604116 0.816907
H -6.379062 -0.537893 1.834244
H -6.220183 -0.058992 -0.898500
H -6.150742 1.334172 0.247245
H -1.895290 1.720915 -1.821241
H -2.663842 0.157919 -2.112233
H -1.242399 0.704914 -4.044768
H -0.533536 -0.711726 -3.210142
H 0.214603 0.907535 -3.053371
H 3.007785 2.005271 -0.357054
H 2.464785 -1.976086 1.320262


