%chk=000158053.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158053

0 1
 Cl  -3.625400      0.3366000      -4.926700    
 F   -2.157500      -2.774700       2.050200    
 F   -2.933500      -1.923800      0.1977000    
 F   -3.733300      -1.268600       2.102500    
 F  -0.1155000      0.5918000       3.084700    
 F   -2.132300      0.1465000       3.741300    
 F  -0.6732000      -1.464400       3.553300    
 O   0.1214000       1.583200      0.3090000    
 O   -1.179900       2.944500       1.640100    
 O    3.995500      -1.114800      -1.266600    
 N   0.8598000       4.282000      -1.621500    
 C   -2.036600      0.7920000      0.8752000    
 C   -1.527000     -0.5324000       1.526500    
 C   -2.438200      0.6763000     -0.5884000    
 C   -2.594900      -1.633200       1.474900    
 C   -1.111800     -0.3185000       2.988700    
 C   -1.005700       1.910100       1.008000    
 C   -1.733400     -0.1748000      -1.439800    
 C   -3.509700       1.422600      -1.079000    
 C    1.169500       2.557000      0.3396000    
 C   -2.100100     -0.2796000      -2.781400    
 C   -3.876500       1.317800      -2.420600    
 C   -3.171800      0.4666000      -3.271800    
 C    2.504400       1.852800      0.2677000    
 C    2.635300      0.6803000     -0.4764000    
 C    3.605700       2.375300      0.9459000    
 C    3.867700      3.0200001E-02 -0.5423000    
 C   0.9977000       3.519800     -0.7573000    
 C    4.837900       1.725100      0.8801000    
 C    4.968900      0.5525000      0.1361000    
 C    3.008700      -2.076700      -1.129700    
 C    2.538500      -2.418000      0.1384000    
 C    2.485700      -2.705100      -2.259800    
 C    1.545200      -3.387700      0.2765000    
 C    1.492400      -3.674700      -2.121800    
 C    1.022200      -4.015900     -0.8537000    
 H   -2.920300       1.115300       1.443800    
 H  -0.6332000     -0.8975000       1.008500    
 H  -0.8814000     -0.7556000      -1.102500    
 H   -4.065500       2.090900     -0.4268000    
 H    1.141700       3.091200       1.298800    
 H   -1.539000     -0.9435000      -3.434200    
 H   -4.713400       1.905600      -2.789000    
 H    1.783800      0.2957000      -1.032200    
 H    3.518400       3.288800       1.528000    
 H    5.695500       2.131700       1.408100    
 H    5.931200      5.0099999E-02  8.9100003E-02
 H    2.942400      -1.959700       1.037100    
 H    2.847700      -2.442500      -3.250000    
 H    1.180300      -3.655000       1.263900    
 H    1.084300      -4.163200      -3.001800    
 H   0.2484000      -4.770200     -0.7462000    


%chk=000158053-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000158053

0 1
Cl -6.422558 2.777651 -3.333487
F -2.860915 -2.496925 1.437569
F -3.695027 -1.352123 -0.315478
F -4.014259 -0.580390 1.796154
F 0.209008 0.250978 2.126522
F -1.518002 -0.671937 3.249166
F -0.211017 -1.953963 1.897295
O 0.009651 1.179444 -0.645333
O -0.447122 3.060419 0.669324
O 4.746226 -1.491171 0.394919
N 1.521331 1.122718 -3.676545
C -2.020736 1.153575 0.674734
C -1.763018 -0.388033 0.814551
C -3.113581 1.531448 -0.340802
C -3.075234 -1.193918 0.938396
C -0.836022 -0.693733 2.014816
C -0.743262 1.915974 0.281394
C -2.951098 1.292559 -1.729206
C -4.292946 2.165132 0.117885
C 1.299052 1.841162 -1.121079
C -3.955677 1.667460 -2.644935
C -5.306562 2.548735 -0.786791
C -5.121694 2.290624 -2.158076
C 2.462135 1.417644 -0.242270
C 3.028684 0.127566 -0.376052
C 2.948187 2.322480 0.731495
C 4.079714 -0.252433 0.486394
C 1.418831 1.434702 -2.530741
C 4.014903 1.930948 1.571554
C 4.583236 0.646635 1.456150
C 4.075229 -2.641804 -0.114966
C 2.783620 -3.007933 0.328125
C 4.810678 -3.458026 -0.998385
C 2.218934 -4.213552 -0.144120
C 4.234526 -4.663843 -1.457560
C 2.938093 -5.043120 -1.037318
H -2.316396 1.552396 1.660929
H -1.241916 -0.753332 -0.087009
H -2.041195 0.816124 -2.109223
H -4.431869 2.358180 1.187061
H 1.142566 2.934441 -1.052638
H -3.832431 1.480387 -3.715288
H -6.218257 3.036087 -0.430824
H 2.665113 -0.564755 -1.142868
H 2.489624 3.310919 0.839842
H 4.399898 2.626283 2.324210
H 5.407438 0.322420 2.098166
H 2.238355 -2.377822 1.037745
H 5.812073 -3.144553 -1.307724
H 1.221301 -4.508031 0.199452
H 4.798689 -5.303648 -2.144661
H 2.494797 -5.977848 -1.396269


