%chk=000047443.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047443

0 1
 O    3.170900       2.162800      0.6209000    
 O    4.198000     -5.4800000E-02   1.748300    
 O    3.529700      -1.460600      -1.551000    
 C    3.920500       1.288600     -0.2318000    
 C    2.490300       1.667100     -0.5414000    
 C    4.208600     -7.7600002E-02  0.3208000    
 C    1.425500      0.6295000     -0.3232000    
 C    3.223900      -1.145000     -0.1938000    
 C    1.771300     -0.7192000     -0.1468000    
 C   6.2899999E-02  0.9791000     -0.2856000    
 C   0.7662000      -1.675400      3.7400000E-02
 C  -0.9793000      3.6800001E-02 -8.9500003E-02
 C  -0.5902000      -1.314900      7.0699997E-02
 C   -2.379200      0.3744000     -4.8599999E-02
 C   -1.559700      -2.302700      0.2636000    
 C   -3.334800     -0.6561000      0.1500000    
 C   -2.911600      -1.978400      0.3028000    
 C   -2.885600       1.690400     -0.1952000    
 C   -4.708000     -0.3603000      0.1947000    
 C   -4.253900       1.971100     -0.1485000    
 C   -5.165400      0.9452000      4.6300001E-02
 H    4.719200       1.710300     -0.8250000    
 H    2.342400       2.368900      -1.356000    
 H    5.224800     -0.3586000      2.1100000E-02
 H    3.356400      -2.057000      0.4015000    
 H  -0.1719000       2.033600     -0.4191000    
 H    1.051100      -2.720100      0.1583000    
 H    3.301700      0.1874000       2.037100    
 H    2.849300      -2.069700      -1.885100    
 H   -1.273500      -3.345500      0.3875000    
 H   -3.632900      -2.779000      0.4556000    
 H   -2.219300       2.535100     -0.3502000    
 H   -5.439700      -1.151800      0.3469000    
 H   -4.601200       2.993600     -0.2652000    
 H   -6.229400       1.158200      8.3099999E-02


%chk=000047443-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047443

0 1
O 3.161114 2.122040 0.782157
O 4.148798 -0.177793 1.785063
O 3.641069 -1.285278 -1.696987
C 3.899096 1.254904 -0.222085
C 2.474646 1.607253 -0.511451
C 4.214644 -0.152421 0.325660
C 1.407381 0.586730 -0.320909
C 3.240653 -1.192877 -0.266753
C 1.782102 -0.786974 -0.139030
C 0.055426 0.955391 -0.299600
C 0.780375 -1.735216 0.087386
C -0.984251 0.001250 -0.087041
C -0.602605 -1.375621 0.118727
C -2.404066 0.362573 -0.060756
C -1.618952 -2.376044 0.351224
C -3.385926 -0.669688 0.172549
C -2.957593 -2.035549 0.376701
C -2.869374 1.699605 -0.256113
C -4.775012 -0.333848 0.201601
C -4.236240 2.007874 -0.224105
C -5.200605 0.984843 0.006426
H 4.697927 1.779826 -0.754921
H 2.262574 2.435108 -1.198639
H 5.238108 -0.442090 0.035926
H 3.411513 -2.163068 0.239888
H -0.193850 2.012482 -0.440163
H 1.053511 -2.786484 0.247466
H 3.586367 0.602990 2.054487
H 2.971392 -1.832856 -2.179792
H -1.304352 -3.414236 0.508320
H -3.723254 -2.800011 0.553646
H -2.154731 2.508982 -0.433707
H -5.506319 -1.130896 0.381026
H -4.565390 3.041507 -0.376243
H -6.267075 1.232990 0.030642


