%chk=000092945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092945

0 1
 O    2.256700      -1.607100      0.3814000    
 O   -7.566200       1.626500     -0.3427000    
 O   -8.180300     -0.4953000      0.2133000    
 C    3.586600      -1.035700      0.2968000    
 C    4.445400       1.432400     -3.1099999E-02
 C    3.370900      0.4499000      0.3890000    
 C    4.191400      -1.409900      -1.060100    
 C    5.060900      0.9469000      -1.372100    
 C    5.406600     -0.5474000      -1.405800    
 C    2.108200      0.6801000      0.7616000    
 C    1.372200     -0.6028000      0.9184000    
 C    4.381100      -1.629500       1.464900    
 C    3.879200       2.852500     -0.2607000    
 C    5.535100       1.551700       1.050500    
 C   9.3599997E-02 -0.6391000      0.1539000    
 C   0.2545000      -1.059500      -1.284600    
 C   -1.128300     -0.3390000      0.6358000    
 C   -2.388000     -0.3649000     -8.1299998E-02
 C   -3.557300     -4.4700000E-02  0.4995000    
 C   -4.880900     -3.3300001E-02 -0.1346000    
 C   -4.955400     -0.4426000      -1.583100    
 C   -5.939500      0.3194000      0.6225000    
 C   -7.346400      0.3914000      0.1684000    
 H    3.437200      -1.298900      -1.850400    
 H    4.468800      -2.471200      -1.074100    
 H    5.963400       1.526900      -1.604200    
 H    4.353200       1.144100      -2.189700    
 H    5.761400     -0.8112000      -2.409100    
 H    6.232700     -0.7604000     -0.7189000    
 H    1.660700       1.653400      0.9010000    
 H    1.206300     -0.8220000       1.979600    
 H    5.444700      -1.386300       1.427000    
 H    3.985600      -1.286900       2.428400    
 H    4.291500      -2.722400       1.469600    
 H    3.070300       2.849000      -1.000900    
 H    3.485200       3.284400      0.6667000    
 H    4.656900       3.530800     -0.6315000    
 H    6.253100       2.341000      0.7973000    
 H    5.100400       1.803000       2.025000    
 H    6.114300      0.6341000       1.171800    
 H    1.113000     -0.5520000      -1.739100    
 H  -0.5825000     -0.8114000      -1.938400    
 H   0.4175000      -2.140600      -1.351800    
 H   -1.189300     -3.9900001E-02   1.681600    
 H   -2.386300     -0.6675000      -1.119900    
 H   -3.541500      0.2492000       1.549400    
 H   -5.980600     -0.4168000      -1.966200    
 H   -4.590900      -1.466600      -1.718500    
 H   -4.363800      0.2338000      -2.209500    
 H   -5.812300      0.5911000       1.668200    
 H   -8.485100       1.729900     -0.6702000    


%chk=000092945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092945

0 1
O 2.157394 -1.519607 0.391418
O -7.955112 0.137936 -0.803072
O -8.391943 0.284908 1.466495
C 3.586120 -1.049928 0.347517
C 4.648255 1.370769 -0.048220
C 3.463857 0.481898 0.328415
C 4.245300 -1.551779 -0.959350
C 5.300538 0.751497 -1.335307
C 5.552236 -0.772791 -1.249273
C 2.178343 0.842511 0.572931
C 1.276519 -0.372720 0.756884
C 4.273885 -1.631600 1.606832
C 4.185889 2.815281 -0.366895
C 5.697966 1.445151 1.103150
C 0.028889 -0.372742 -0.122410
C 0.266727 -0.458765 -1.611503
C -1.203711 -0.281796 0.485366
C -2.496872 -0.215255 -0.169370
C -3.687375 -0.108169 0.520212
C -5.018906 -0.039973 -0.082629
C -5.130504 -0.102593 -1.594266
C -6.091513 0.079481 0.789026
C -7.533244 0.174447 0.547466
H 3.526537 -1.390635 -1.785869
H 4.437590 -2.639180 -0.892845
H 6.250336 1.284734 -1.540123
H 4.627330 0.949327 -2.194895
H 5.983423 -1.125256 -2.205736
H 6.308233 -0.993597 -0.470347
H 1.783234 1.859901 0.617308
H 0.962090 -0.484438 1.818540
H 5.371117 -1.514378 1.578248
H 3.894263 -1.146814 2.523137
H 4.043675 -2.709939 1.662076
H 3.408882 2.824052 -1.153001
H 3.776786 3.315884 0.530198
H 5.042579 3.416044 -0.725104
H 6.510030 2.141258 0.820291
H 5.231165 1.820591 2.031799
H 6.156041 0.467380 1.325794
H 0.872932 0.400231 -1.960195
H -0.664483 -0.485843 -2.198169
H 0.853455 -1.368887 -1.833111
H -1.224838 -0.254635 1.586415
H -2.520892 -0.252086 -1.265487
H -3.647211 -0.069144 1.619325
H -6.174905 -0.052616 -1.924562
H -4.681217 -1.040594 -1.971997
H -4.570762 0.733972 -2.054124
H -5.876047 0.114846 1.864589
H -8.948083 0.210260 -0.802473


