%chk=000013791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013791

0 1
 O    3.226400      0.3350000      6.9200002E-02
 O    4.711700      -1.056400      -1.017500    
 O   -7.715100      0.9258000      0.5068000    
 C   0.7710000      0.1071000      4.8000000E-02
 C  -9.7499996E-02  -1.111700     -0.3233000    
 C   -1.550600     -0.9408000      0.1187000    
 C   -2.151800      0.2981000     -0.6121000    
 C    2.136500     -0.3975000     -0.4563000    
 C   0.2203000       1.329700     -0.6960000    
 C   0.7095000      -2.296000      0.2014000    
 C   -1.273200       1.559600     -0.3947000    
 C    2.174200      -1.874000     -1.5400000E-02
 C   -2.408600      -2.167900     -0.1952000    
 C   0.8389000      0.4190000       1.565100    
 C   -3.630500      0.4740000     -0.2774000    
 C   -3.803200      -1.989500      0.3972000    
 C   -4.403200     -0.6256000      0.1567000    
 C   -4.280100       1.705100     -0.4766000    
 C   -5.772300     -0.4559000      0.4284000    
 C    4.478300     -0.1006000     -0.2905000    
 C   -5.642900       1.857400     -0.2117000    
 C   -6.388300      0.7785000      0.2455000    
 C    5.523700      0.7846000      0.3488000    
 C    6.942700      0.3358000      3.8000001E-03
 C    7.985900       1.263600      0.6250000    
 C    9.398200      0.8425000      0.2521000    
 H  -0.1079000      -1.214200      -1.421500    
 H   -1.587600     -0.7820000       1.204100    
 H   -2.128700      8.9500003E-02  -1.693100    
 H    2.169300     -0.3399000      -1.553500    
 H   0.3361000       1.191900      -1.779100    
 H   0.7912000       2.230000     -0.4385000    
 H   0.4779000      -3.220800     -0.3368000    
 H   0.5161000      -2.474100       1.265100    
 H   -1.395900       1.924300      0.6323000    
 H   -1.609600       2.372500      -1.048500    
 H    2.755200      -2.026200      0.9013000    
 H    2.627200      -2.497400     -0.7943000    
 H   -1.963600      -3.080200      0.2173000    
 H   -2.479100      -2.310000      -1.281400    
 H    1.475400       1.292200       1.750400    
 H  -0.1402000      0.6464000       1.994800    
 H    1.256200     -0.4105000       2.144500    
 H   -3.753100      -2.147600       1.482200    
 H   -4.461000      -2.763000     -1.7500000E-02
 H   -3.741600       2.571000     -0.8497000    
 H   -6.361400      -1.298900      0.7840000    
 H   -6.108500       2.826300     -0.3719000    
 H    5.361900       1.809000     -4.9000001E-03
 H    5.380300      0.7543000       1.434600    
 H    7.102000     -0.6911000      0.3556000    
 H    7.068300      0.3180000      -1.086100    
 H   -7.972400       1.845700      0.3235000    
 H    7.884100       1.259900       1.716500    
 H    7.818200       2.292800      0.2867000    
 H    9.610200     -0.1727000      0.6023000    
 H    9.542200      0.8691000     -0.8328000    
 H    10.12820       1.518600      0.7081000    


%chk=000013791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013791

0 1
O 3.348198 -0.355595 0.534986
O 4.725577 -1.193600 -1.154607
O -7.570597 1.616502 -0.006170
C 0.851138 -0.318093 0.320045
C -0.152951 -1.439719 -0.106876
C -1.613222 -1.069465 0.201590
C -1.968793 0.236117 -0.580054
C 2.168206 -1.024850 -0.087312
C 0.515187 0.966967 -0.470901
C 0.462269 -2.741603 0.475877
C -0.967034 1.387711 -0.272256
C 2.010154 -2.503554 0.382241
C -2.622701 -2.175482 -0.173458
C 0.848245 -0.036234 1.846020
C -3.444632 0.622941 -0.388608
C -4.035965 -1.794504 0.312348
C -4.418823 -0.350673 -0.006913
C -3.891876 1.945172 -0.639718
C -5.778629 0.018400 0.109809
C 4.581909 -0.526895 -0.102727
C -5.247178 2.317365 -0.523003
C -6.195310 1.339681 -0.144277
C 5.686895 0.188583 0.656563
C 6.720829 0.851707 -0.283390
C 7.921744 1.440700 0.488975
C 8.940240 2.135523 -0.439997
H -0.075629 -1.518221 -1.217486
H -1.718389 -0.875547 1.290965
H -1.833101 -0.017722 -1.658529
H 2.311967 -0.982439 -1.184171
H 0.696365 0.784494 -1.551294
H 1.181012 1.798637 -0.168176
H 0.148338 -3.636943 -0.088553
H 0.147016 -2.891181 1.525782
H -1.131810 1.748216 0.761966
H -1.167954 2.249535 -0.936222
H 2.497663 -2.630132 1.365770
H 2.503620 -3.193694 -0.322118
H -2.325118 -3.141896 0.275955
H -2.619619 -2.313626 -1.274561
H 1.654406 0.676759 2.090129
H -0.107471 0.400268 2.180529
H 1.025063 -0.950251 2.439722
H -4.084807 -1.934780 1.412745
H -4.791855 -2.480422 -0.116139
H -3.171623 2.713830 -0.937363
H -6.532827 -0.721817 0.399167
H -5.557090 3.351009 -0.725857
H 5.236160 0.921788 1.347466
H 6.202107 -0.568868 1.282982
H 7.072023 0.101284 -1.016784
H 6.226903 1.654192 -0.867042
H -7.756521 2.565636 -0.213804
H 8.426690 0.629168 1.052394
H 7.556750 2.165149 1.245703
H 9.341834 1.426790 -1.188406
H 8.468705 2.971534 -0.990066
H 9.793717 2.544946 0.130811


