%chk=000172997.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172997

0 1
 Cl  0.8846000      0.7061000      -3.112200    
 F   -8.627300      -1.503300      -1.008400    
 O    2.549100      -1.565600      -1.880600    
 O   -3.894400      -1.157300       1.620100    
 N    4.744400       2.005000      0.4396000    
 N    3.036800     -0.4573000      0.1535000    
 N   -3.360500     -5.0200000E-02 -0.3843000    
 C    2.681300      0.7465000      0.9236000    
 C    3.386500       1.897400      0.3143000    
 C    5.542800       1.117600       1.265800    
 C    5.476900     -0.3445000      0.8706000    
 C    4.347200      -1.052000      0.3765000    
 C    2.952700       2.955800     -0.4562000    
 C    5.191900       3.107000     -0.2350000    
 C    2.197600     -0.9527000     -0.8728000    
 C    6.687000      -1.052100       1.073500    
 C    4.499500      -2.434500      0.1184000    
 C    4.095400       3.718200     -0.8053000    
 C   0.7526000     -0.6974000     -0.7766000    
 C    6.807700      -2.408700      0.7895000    
 C    5.710000      -3.101700      0.3132000    
 C   7.0699997E-02  4.1200001E-02  -1.741600    
 C   6.7900002E-02  -1.222000      0.3181000    
 C   -1.988800     -0.2686000     -0.5171000    
 C   -1.301500      0.2558000      -1.611800    
 C   -1.304300      -1.007300      0.4482000    
 C   -5.639900     -0.1186000      0.4863000    
 C   -4.209000     -0.4904000      0.6402000    
 C   -6.107000       1.067100       1.015100    
 C   -6.462400     -0.9944000     -0.1941000    
 C   -7.454400       1.392100      0.8566000    
 C   -5.217700       2.014600       1.752200    
 C   -7.809600     -0.6695000     -0.3523000    
 C   -8.305700      0.5238000      0.1729000    
 H    1.606600      0.9402000      0.8965000    
 H    2.941500      0.5939000       1.977100    
 H    6.574200       1.487600       1.209900    
 H    5.206100       1.239400       2.302200    
 H    1.929200       3.150300     -0.7450000    
 H    6.240000       3.373400     -0.2519000    
 H    7.562000     -0.5343000       1.463800    
 H    3.656500      -3.036600     -0.2145000    
 H    4.118200       4.616600      -1.405900    
 H    7.751400      -2.919600      0.9527000    
 H    5.783500      -4.164800      0.1039000    
 H   0.5874000      -1.804400       1.075200    
 H   -1.837500      0.8327000      -2.362800    
 H   -1.764200      -1.446000       1.322200    
 H   -3.789900      0.4951000      -1.129100    
 H   -6.083100      -1.925200     -0.6054000    
 H   -7.857600       2.317600       1.259100    
 H   -4.435900       2.400100       1.089700    
 H   -4.753100       1.518100       2.610500    
 H   -5.772300       2.876600       2.139100    
 H   -9.354700      0.7764000      4.9300000E-02


%chk=000172997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000172997

0 1
Cl 1.001994 0.351650 -3.065130
F -7.976955 -0.333272 -2.496877
O 2.608695 -2.032144 -1.419913
O -3.945627 -0.504626 1.916220
N 4.825082 1.956034 0.007780
N 3.204084 -0.610288 0.365028
N -3.347704 0.099868 -0.274118
C 2.922786 0.709546 1.024065
C 3.445070 1.851445 0.207195
C 5.806424 1.159969 0.753856
C 5.717337 -0.369768 0.638488
C 4.536518 -1.163725 0.489037
C 2.822647 2.851366 -0.553083
C 5.087763 3.022603 -0.854580
C 2.295533 -1.148268 -0.570866
C 6.961409 -1.043166 0.778051
C 4.651932 -2.582179 0.490070
C 3.860658 3.594756 -1.217464
C 0.855827 -0.694482 -0.457618
C 7.068725 -2.445971 0.772270
C 5.895820 -3.220228 0.627305
C 0.144623 -0.111647 -1.531001
C 0.110634 -1.015582 0.708146
C -1.955073 -0.179572 -0.279616
C -1.231236 0.156026 -1.455647
C -1.271125 -0.773098 0.815849
C -5.695890 0.232335 0.379484
C -4.271848 -0.093601 0.762084
C -6.565418 0.892552 1.303582
C -6.176586 -0.178098 -0.893151
C -7.900930 1.142194 0.895618
C -6.107341 1.335261 2.681062
C -7.509472 0.087905 -1.235965
C -8.392329 0.747512 -0.368146
H 1.838146 0.819877 1.156366
H 3.376394 0.669708 2.032772
H 6.808005 1.469527 0.411351
H 5.745837 1.441235 1.827605
H 1.748203 3.009424 -0.636738
H 6.105356 3.282279 -1.141194
H 7.871205 -0.439477 0.888846
H 3.748377 -3.183506 0.371250
H 3.728723 4.438221 -1.892926
H 8.048133 -2.924908 0.873279
H 5.946897 -4.314015 0.620986
H 0.634927 -1.485594 1.548439
H -1.736133 0.619209 -2.310647
H -1.822345 -1.030693 1.720629
H -3.717558 0.530798 -1.125321
H -5.548466 -0.739684 -1.592615
H -8.574519 1.658692 1.587857
H -5.171343 1.920388 2.636535
H -5.890708 0.463426 3.321602
H -6.880851 1.953548 3.167380
H -9.425905 0.937441 -0.670973


