%chk=000051453.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051453

0 1
 Cl   6.791400      -2.970100      0.3891000    
 F   -3.138400      -4.987800     -0.3408000    
 O   -3.802700       2.735900      0.4223000    
 O   -5.266300      0.9996000     -7.9700001E-02
 O   -6.019400       3.163700      1.8300001E-02
 N   0.5754000       1.665300     -0.1119000    
 N    3.284100      0.7587000     -0.1318000    
 C    1.416600       1.862900      -1.298500    
 C   0.9435000      0.4119000      0.5581000    
 C    2.897400       1.934500     -0.9177000    
 C    2.408100      0.4361000       1.001600    
 C  -0.8394000       1.652500     -0.4821000    
 C   -1.709700       1.523100      0.7641000    
 C    4.632500      0.3947000     -4.5200001E-02
 C   -3.152200       1.516300      0.4141000    
 C    5.011700     -0.9535000      0.1120000    
 C    5.651800       1.365300     -0.1133000    
 C   -3.981000      0.5335000      0.1228000    
 C    6.356000      -1.316200      0.1974000    
 C    6.995900       1.002700     -2.7899999E-02
 C   -3.762000     -0.9071000      1.1000000E-03
 C    7.348000     -0.3380000      0.1273000    
 C   -5.098800       2.360500      0.1125000    
 C   -3.905700      -1.743500       1.116100    
 C   -3.404800      -1.470300      -1.231500    
 C   -3.696000      -3.117700       1.000900    
 C   -3.195100      -2.844500      -1.346800    
 C   -3.340800      -3.668300     -0.2306000    
 H    1.146800       2.800600      -1.799400    
 H    1.263100       1.050500      -2.021800    
 H   0.7697000     -0.4501000     -0.1000000    
 H   0.3792000      0.2468000       1.478800    
 H    3.484400       1.992200      -1.842800    
 H    3.085500       2.847900     -0.3390000    
 H    2.552500       1.183900       1.792300    
 H    2.650800     -0.5417000       1.433600    
 H   -1.054000      0.8380000      -1.187000    
 H   -1.090900       2.592300     -0.9911000    
 H   -1.527300      0.5912000       1.306500    
 H   -1.502100       2.339000       1.467900    
 H    4.244400      -1.724700      0.1545000    
 H    5.415500       2.420900     -0.2213000    
 H    7.768500       1.764300     -7.9400003E-02
 H    8.399500     -0.6057000      0.1931000    
 H   -4.181800      -1.330800       2.083900    
 H   -3.286300     -0.8423000      -2.111700    
 H   -3.808800      -3.759400       1.869800    
 H   -2.917900      -3.273400      -2.305200    


%chk=000051453-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051453

0 1
Cl 7.494017 -2.618461 0.308072
F -4.635657 -5.192383 -0.213255
O -3.566397 2.640867 0.495675
O -5.285208 1.204995 0.054122
O -5.732796 3.528166 0.123371
N 0.747375 1.398254 -0.000757
N 3.591579 0.853332 -0.144703
C 1.606161 2.063692 -1.011301
C 1.276809 0.043312 0.288102
C 3.059522 2.179061 -0.515343
C 2.719259 0.135909 0.812380
C -0.681409 1.406651 -0.379206
C -1.605733 1.157416 0.847341
C 4.986181 0.619588 -0.159574
C -3.054390 1.298607 0.520792
C 5.503206 -0.693790 0.072870
C 5.923303 1.660197 -0.446966
C -4.080370 0.433910 0.239978
C 6.885530 -0.916107 0.011764
C 7.305745 1.390352 -0.511463
C -4.206575 -1.015631 0.112140
C 7.820941 0.094898 -0.280250
C -4.961436 2.579032 0.212810
C -5.492980 -1.618846 0.208934
C -3.070711 -1.843026 -0.119582
C -5.643896 -3.014760 0.100150
C -3.207839 -3.241051 -0.220993
C -4.494244 -3.797369 -0.104868
H 1.213226 3.079757 -1.198412
H 1.603911 1.505651 -1.981674
H 1.257237 -0.603287 -0.626801
H 0.656245 -0.438460 1.064976
H 3.664996 2.598268 -1.336460
H 3.097730 2.885216 0.345494
H 2.706019 0.669673 1.789526
H 3.102261 -0.880108 0.989662
H -0.913975 0.658349 -1.180399
H -0.922136 2.404122 -0.790206
H -1.433048 0.153079 1.272963
H -1.335079 1.893163 1.626346
H 4.839266 -1.539910 0.262956
H 5.583801 2.688406 -0.594583
H 8.000139 2.209355 -0.729431
H 8.892142 -0.115711 -0.319053
H -6.370181 -0.985853 0.368991
H -2.079972 -1.398422 -0.252132
H -6.625474 -3.491028 0.172693
H -2.346194 -3.889375 -0.403095


