%chk=000179913.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179913

0 1
Cl -4.281047 -0.084457 2.135619
Cl 2.268147 -3.150159 0.751901
F -4.567881 1.009453 -1.953567
F -5.489768 -0.185674 -0.469549
F -4.808246 1.762046 0.009008
F 5.090787 2.422910 -1.732585
F 3.039275 2.901621 -1.898509
F 4.054709 3.203550 -0.064310
O -0.440983 -1.223702 3.431367
O -2.556586 -1.614955 3.525914
O -0.021040 -0.523422 -2.868109
O 0.847008 -1.942676 -1.484521
N 0.688973 -0.657693 1.199297
N -1.573966 -1.216994 2.942912
N 0.070824 -1.047557 -1.773621
C -0.562879 -0.693982 0.675861
C -1.706754 -0.717869 1.574584
C -0.859022 -0.593892 -0.730402
C -3.137239 0.093273 -0.250214
C 1.918369 -0.494992 0.458351
C -2.946002 -0.263247 1.097803
C -2.104729 -0.133750 -1.165224
C 2.300314 0.780979 0.024607
C 3.535033 0.941620 -0.620607
C 2.767127 -1.601420 0.241828
C -4.460930 0.654022 -0.665732
C 4.378834 -0.157946 -0.831626
C 3.995279 -1.431194 -0.398881
C 3.927152 2.324141 -1.072881
H 0.827234 -0.847478 2.230092
H -2.259720 0.028436 -2.246482
H 1.639055 1.637065 0.193760
H 5.342101 -0.040310 -1.338323
H 4.646171 -2.293047 -0.572960


%chk=000179913-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179913

0 1
Cl -4.315507 -0.075907 2.306200
Cl 2.760546 -3.169854 1.422898
F -4.412674 1.205729 -2.013693
F -5.590631 0.016317 -0.495518
F -4.757226 2.054373 0.055372
F 4.402066 2.082982 -2.559493
F 2.510544 2.914831 -1.610625
F 4.492396 3.048143 -0.515815
O -0.378678 -1.472143 3.381214
O -2.572602 -2.047493 3.359423
O -0.076479 -0.096337 -2.964591
O 0.832749 -1.778584 -1.713666
N 0.693314 -0.973166 1.084534
N -1.566953 -1.470009 2.821690
N 0.021299 -0.786481 -1.878313
C -0.571268 -0.759322 0.608431
C -1.720043 -0.813693 1.507604
C -0.893515 -0.458821 -0.765599
C -3.173722 0.218588 -0.193965
C 1.940442 -0.680793 0.460880
C -2.975577 -0.266824 1.124005
C -2.137843 0.059516 -1.133381
C 2.170790 0.565991 -0.168755
C 3.440535 0.865025 -0.695655
C 3.023512 -1.585894 0.592002
C -4.465264 0.858993 -0.644744
C 4.507743 -0.057836 -0.582909
C 4.296059 -1.286573 0.070771
C 3.696316 2.200736 -1.338487
H 0.711647 -1.266408 2.085376
H -2.294277 0.329759 -2.181194
H 1.364411 1.302535 -0.236055
H 5.490006 0.177532 -1.002442
H 5.107486 -2.012210 0.169305


