%chk=000050516.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050516

0 1
 Cl   3.578100       3.053200      -1.969600    
 F    4.240500      -1.722800       2.169600    
 F    5.106500      -1.759700      0.1814000    
 F    5.850000     -0.3514000       1.662200    
 O   -2.475000       1.926200      0.1465000    
 O  -0.8969000       1.101800      -1.317200    
 O   -2.058600      -3.799500      0.2463000    
 N   0.9206000       2.948300     -0.5171000    
 N   -5.861900       1.761700     -9.5500000E-02
 C   -1.034800       4.428000     -0.2135000    
 C  -0.4031000       3.047800      6.3199997E-02
 C  -0.1935000       5.554500      0.3951000    
 C   -1.271200       4.699200      -1.703500    
 C   -1.256200       1.910600     -0.4710000    
 C    1.860700       2.014900     -0.1203000    
 C   -3.383500      0.8955000     -0.2539000    
 C    3.122900       1.960300     -0.7114000    
 C    1.525500       1.116200      0.8925000    
 C   -3.156300     -0.3279000      0.6032000    
 C    3.714600      0.1086000      0.7230000    
 C    4.050000       1.007300     -0.2897000    
 C    2.452400      0.1631000       1.314100    
 C   -2.707400      -1.513700      2.1700000E-02
 C   -3.395500     -0.2713000       1.976200    
 C    4.705000     -0.9112000       1.173800    
 C   -2.497400      -2.642700      0.8133000    
 C   -4.768600       1.378600     -0.1637000    
 C   -3.185600      -1.400500       2.767900    
 C   -2.736600      -2.586100       2.186400    
 C   -1.020100      -3.715800     -0.6661000    
 C   9.2699997E-02  -2.923000     -0.3853000    
 C   -1.087000      -4.424200      -1.865700    
 C    1.138700      -2.838800      -1.304200    
 C  -4.0899999E-02  -4.339900      -2.784600    
 C    1.072000      -3.547300      -2.504000    
 H   -2.017500       4.459200      0.2761000    
 H  -0.3481000       2.949500       1.154700    
 H   0.7836000       5.643600     -9.0899996E-02
 H  -2.9200001E-02   5.383900       1.464200    
 H  -0.7058000       6.516800      0.2880000    
 H  -0.3355000       4.743500      -2.269100    
 H   -1.780000       5.660300      -1.837900    
 H   -1.906900       3.930600      -2.154100    
 H    1.166000       3.547700      -1.296500    
 H   -3.220300      0.6470000      -1.311500    
 H   0.5622000       1.098200       1.390100    
 H    5.035900      0.9588000     -0.7467000    
 H    2.172400     -0.5307000       2.102200    
 H   -2.547000      -1.551100      -1.053000    
 H   -3.738900      0.6459000       2.447400    
 H   -3.370000      -1.356000       3.837300    
 H   -2.573800      -3.462100       2.808200    
 H   0.1807000      -2.377500      0.5506000    
 H   -1.951700      -5.042800      -2.089700    
 H    2.007700      -2.225700      -1.084300    
 H  -9.2900001E-02  -4.891600      -3.718700    
 H    1.886900      -3.482400      -3.218900    


%chk=000050516-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050516

0 1
Cl 3.505157 2.987200 -2.135821
F 4.430959 -1.566642 2.371934
F 4.584810 -2.209915 0.203680
F 5.998038 -0.637506 1.005967
O -2.400507 1.895580 0.433326
O -1.340587 1.485297 -1.615535
O -1.757406 -3.757528 0.363262
N 0.921625 2.985213 -0.560657
N -5.782203 2.217345 0.531653
C -0.985349 4.595251 -0.376705
C -0.416130 3.175253 -0.021487
C -0.195679 5.689058 0.379317
C -1.018725 4.868627 -1.900313
C -1.390967 2.088344 -0.525028
C 1.794811 1.995455 -0.146916
C -3.507152 0.920098 0.045740
C 3.075364 1.849756 -0.767158
C 1.496543 1.088528 0.917390
C -3.343406 -0.381255 0.811533
C 3.679047 0.004452 0.685488
C 4.004129 0.884645 -0.378337
C 2.422685 0.114688 1.325014
C -2.591394 -1.418802 0.207375
C -3.911683 -0.556307 2.096322
C 4.645978 -1.066249 1.067004
C -2.411052 -2.634495 0.905763
C -4.763005 1.635391 0.323114
C -3.724979 -1.780350 2.776153
C -2.977384 -2.821139 2.189166
C -0.749758 -3.620706 -0.637178
C 0.290230 -2.670616 -0.528283
C -0.775598 -4.567498 -1.681865
C 1.318076 -2.669396 -1.497005
C 0.259870 -4.555129 -2.643242
C 1.305830 -3.606649 -2.556518
H -2.027373 4.596516 -0.001289
H -0.394272 3.105029 1.082324
H 0.868973 5.693157 0.083063
H -0.244268 5.539777 1.473441
H -0.615411 6.685764 0.153745
H -0.004140 5.013442 -2.320527
H -1.575259 5.802048 -2.095826
H -1.509411 4.055486 -2.463595
H 1.168079 3.493725 -1.412215
H -3.405028 0.746267 -1.043424
H 0.528797 1.145177 1.423612
H 4.973117 0.819619 -0.881116
H 2.172660 -0.559553 2.149754
H -2.164044 -1.283717 -0.792185
H -4.500148 0.246557 2.552947
H -4.165980 -1.926966 3.767447
H -2.828501 -3.778822 2.696466
H 0.309425 -1.956817 0.301282
H -1.590964 -5.295742 -1.723119
H 2.134361 -1.944795 -1.412372
H 0.248028 -5.287773 -3.457460
H 2.109071 -3.603277 -3.300505


