%chk=000099531.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099531

0 1
 O    2.138100      -1.156400      -1.739600    
 O  -8.0399998E-02   2.618600     -3.1599998E-02
 O   0.1980000      -2.911100     -0.4944000    
 O    2.304100      -1.280600       1.923500    
 O    3.193800       1.884300       1.247400    
 O    4.511200     -0.6962000      0.8129000    
 O    4.677800     -0.6223000      -1.490000    
 O    1.283800       3.798200       1.321300    
 O   -6.083300     -0.1832000      0.3134000    
 O   -4.731900      -2.111300       1.606900    
 C   0.4932000      0.3485000     -0.8784000    
 C  -0.2930000     -0.5579000      0.1509000    
 C    1.891700      0.6865000     -0.3603000    
 C   -1.853800     -0.6680000     -0.1297000    
 C    2.523400     -0.6950000     -0.4190000    
 C  -0.2167000       1.674500      -1.143800    
 C   0.4527000      -1.893900      0.4665000    
 C   -2.426300      0.7868000     -0.2401000    
 C   0.9436000     -0.4272000      -2.128500    
 C    1.979900      -1.704500      0.6042000    
 C   -1.721000       1.537100      -1.396400    
 C    1.869200       1.500800      0.9138000    
 C   -2.536500      -1.334600       1.085700    
 C   -2.219300      -1.495800      -1.391100    
 C   -3.960500      0.8326000     -0.2632000    
 C    4.020600     -0.6660000     -0.4588000    
 C    1.033700       2.749800      0.7326000    
 C   -4.045700      -1.268000       1.028100    
 C   -4.705300     -0.1395000      0.3095000    
 C   -4.579100       2.067500     -0.8740000    
 C    5.938000     -0.6736000      0.9222000    
 H  -0.2531000     -1.1100000E-02   1.103100    
 H    2.409600       1.312900      -1.108900    
 H   0.2274000       2.182600      -2.009000    
 H   6.7100003E-02  -2.273500       1.420600    
 H   -2.162900       1.322900      0.6853000    
 H   0.2295000      -1.144500      -2.525200    
 H    1.230400      0.2424000      -2.947600    
 H    2.465400      -2.677400      0.4507000    
 H   -1.904700       1.047900      -2.358400    
 H   -2.125200       2.552300      -1.483200    
 H    1.458300      0.9640000       1.770400    
 H   -2.229500     -0.8558000       2.023500    
 H   -2.257700      -2.393500       1.142200    
 H   -1.761200      -1.111900      -2.301100    
 H   -1.946100      -2.548200      -1.288700    
 H   -3.296100      -1.496400      -1.589700    
 H   0.6091000      -3.732100     -0.1748000    
 H    3.260300      -1.395100       2.050100    
 H    3.162500       2.327600       2.112400    
 H   -4.102900       2.966500     -0.4676000    
 H   -5.645200       2.181100     -0.6647000    
 H   -4.454200       2.058500      -1.961400    
 H   -6.433800      0.4745000     -0.3062000    
 H    6.335900      0.2487000      0.4886000    
 H    6.369300      -1.550600      0.4305000    
 H    6.197500     -0.7030000       1.983800    


%chk=000099531-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099531

0 1
O 2.089731 -1.320906 -1.654555
O -0.102374 2.674156 -0.147756
O 0.246018 -2.985499 -0.435943
O 2.115860 -1.123193 2.114194
O 3.248483 1.899374 1.223150
O 4.614655 -1.120489 0.834143
O 4.745330 -0.195080 -1.302396
O 1.248161 3.832345 1.290105
O -6.103981 -0.202861 0.390154
O -4.767638 -2.232413 1.575745
C 0.466725 0.307368 -0.898999
C -0.320932 -0.552263 0.151664
C 1.893868 0.661249 -0.366917
C -1.866561 -0.689978 -0.149008
C 2.537888 -0.742154 -0.335807
C -0.254280 1.625983 -1.245684
C 0.421560 -1.880994 0.523800
C -2.430488 0.774345 -0.251885
C 0.913860 -0.512509 -2.137311
C 1.941075 -1.668227 0.766226
C -1.770898 1.525769 -1.436786
C 1.877032 1.516518 0.894555
C -2.547560 -1.361840 1.074622
C -2.218974 -1.527405 -1.412424
C -3.959483 0.838034 -0.255430
C 4.067175 -0.652834 -0.366220
C 1.012475 2.768090 0.677360
C -4.077285 -1.332400 1.023065
C -4.701719 -0.163790 0.332041
C -4.612270 2.083910 -0.823971
C 6.083669 -0.945014 0.980525
H -0.291360 0.028381 1.100254
H 2.431050 1.241172 -1.146391
H 0.223091 2.090332 -2.131683
H 0.000824 -2.262851 1.468087
H -2.100175 1.313200 0.668352
H 0.174981 -1.231696 -2.514300
H 1.260105 0.145273 -2.957098
H 2.428636 -2.661468 0.691296
H -1.985596 1.019562 -2.396465
H -2.155224 2.556271 -1.521696
H 1.445574 0.954109 1.745931
H -2.238796 -0.844463 2.009718
H -2.251271 -2.420226 1.174858
H -1.883599 -1.057696 -2.353446
H -1.752374 -2.521647 -1.338014
H -3.312100 -1.654782 -1.496214
H 0.947908 -2.871296 -1.135965
H 3.095435 -1.022262 2.256354
H 3.206718 2.774664 1.696526
H -4.105791 2.993016 -0.447712
H -5.677460 2.188714 -0.545442
H -4.557177 2.117346 -1.929505
H -6.501855 0.541754 -0.126640
H 6.321716 0.131086 0.992638
H 6.605205 -1.433739 0.142066
H 6.332110 -1.421142 1.938935


