%chk=000217011.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217011

0 1
F 5.561434 -0.078360 -0.181574
F 4.251250 1.498953 0.317475
F 4.477564 -0.147081 1.628707
O -3.728030 0.902520 1.409001
O -0.728454 2.437958 -0.373783
O -1.605676 4.522399 -0.404656
N -0.509731 -0.610720 -0.007903
N -2.995093 1.152294 -0.735380
C -1.571009 -1.535001 0.103431
C -2.889877 -1.055974 0.295534
C 0.796232 -0.923670 -0.480152
C 1.896873 -0.298741 0.139890
C 3.184749 -0.536193 -0.352485
C -1.342889 -2.930123 0.057332
C -3.946459 -1.971076 0.433057
C 0.999167 -1.780063 -1.582653
C -3.226652 0.388827 0.425531
C 3.393934 -1.391662 -1.437937
C -2.409585 -3.814225 0.176321
C -3.717205 -3.342048 0.358029
C 2.292537 -2.010316 -2.044202
C -3.097561 2.613790 -0.668064
C 4.341451 0.155907 0.326538
C -1.773844 3.329696 -0.461824
C 0.612790 2.988951 -0.140132
C 0.814386 3.183699 1.345795
H -0.649811 0.348068 0.340196
H 1.741073 0.349814 1.004212
H -0.330440 -3.319378 -0.035804
H -4.957767 -1.591083 0.603718
H 0.147700 -2.247176 -2.079701
H 4.394875 -1.586945 -1.823587
H -2.224676 -4.889474 0.138395
H -4.543124 -4.043004 0.454536
H 2.452105 -2.675247 -2.895360
H -2.465626 0.774264 -1.517381
H -3.782527 2.906170 0.180198
H -3.572606 3.006463 -1.600819
H 0.716176 3.929785 -0.711880
H 1.246905 2.196543 -0.577989
H 1.866234 3.391547 1.583403
H 0.223454 4.032808 1.722976
H 0.507352 2.304406 1.925389


%chk=000217011-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217011

0 1
F 5.477761 0.086827 -0.569393
F 3.971137 1.713631 -0.076115
F 4.412680 0.088190 1.433118
O -4.330266 0.745290 0.849405
O -0.490614 2.583222 -0.098816
O -1.578904 4.623239 -0.448095
N -0.572961 -0.781543 -0.098227
N -2.657734 1.105599 -0.722650
C -1.669780 -1.678413 0.019205
C -3.005632 -1.174842 0.160383
C 0.727426 -1.070794 -0.566429
C 1.814447 -0.324107 -0.042034
C 3.119658 -0.518809 -0.542769
C -1.458965 -3.084146 0.090648
C -4.069480 -2.083005 0.394641
C 0.987313 -2.025823 -1.593063
C -3.380996 0.284761 0.140471
C 3.382361 -1.472268 -1.550942
C -2.538143 -3.967611 0.280454
C -3.854840 -3.472878 0.437410
C 2.299480 -2.221409 -2.064694
C -2.849297 2.548515 -0.733105
C 4.227592 0.309455 0.039520
C -1.602737 3.374821 -0.410385
C 0.780719 3.328868 0.219476
C 0.907280 3.535519 1.729124
H -0.694992 0.156331 0.300552
H 1.634315 0.394219 0.765210
H -0.440869 -3.480324 0.046986
H -5.068087 -1.660007 0.544118
H 0.160767 -2.587964 -2.036709
H 4.398163 -1.617835 -1.926681
H -2.343789 -5.044475 0.336309
H -4.691701 -4.158228 0.602680
H 2.479121 -2.955127 -2.857262
H -1.954182 0.692914 -1.337828
H -3.628011 2.777389 0.019015
H -3.232116 2.913360 -1.705675
H 0.755444 4.290483 -0.320372
H 1.576481 2.686042 -0.186328
H 1.882112 4.005462 1.954167
H 0.109585 4.196797 2.107212
H 0.859850 2.575976 2.273865


