%chk=000075987.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075987

0 1
 O  -0.1874000      -3.500800     -0.2901000    
 O    3.564100      -1.787700      0.3609000    
 O   -2.305700     -0.7359000     -0.3368000    
 O    2.050400       1.348700      0.2817000    
 O   -3.450100     -0.1546000       1.581900    
 O    1.331600       2.203400      -1.736700    
 C   -1.356700      -2.871200     -0.8192000    
 C    3.668600     -0.3790000      0.5808000    
 C   1.4400000E-02  -2.461500      -1.256400    
 C    2.938600      -1.265400       1.540300    
 C   -2.117900      -2.060100      0.1723000    
 C    2.926800      0.4524000     -0.4086000    
 C   -1.771800       2.079900     -0.5298000    
 C  -0.9098000       2.349100      0.7098000    
 C   -3.124300       1.467500     -0.1753000    
 C   0.4152000       3.027500      0.3605000    
 C   -2.992500      0.1142000      0.4786000    
 C    1.306600       2.173400     -0.5139000    
 H   -1.978700      -3.418500      -1.513300    
 H    4.620200      3.5799999E-02  0.8817000    
 H   0.4107000      -1.519700     -0.9026000    
 H   0.3465000      -2.755400      -2.243300    
 H    1.856700      -1.240000       1.561400    
 H    3.406600      -1.484200       2.491200    
 H   -1.576800      -2.001900       1.124700    
 H   -3.094300      -2.524900      0.3504000    
 H    2.339800     -0.1753000      -1.088300    
 H    3.643300       1.031800      -1.002400    
 H   -1.238800       1.420400      -1.223800    
 H   -1.945200       3.024100      -1.060200    
 H   -1.461800       2.991400       1.406200    
 H  -0.7027000       1.407200       1.231500    
 H   -3.669600       2.129100      0.5076000    
 H   -3.741800       1.352100      -1.073100    
 H   0.2393000       3.974600     -0.1631000    
 H   0.9618000       3.286200       1.275400    


%chk=000075987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075987

0 1
O 0.026883 -1.577092 0.147449
O 4.203987 -1.880879 0.432900
O -2.796223 -0.779422 -0.428882
O 2.367418 1.381204 0.116062
O -3.168049 -0.163678 1.798661
O 0.969030 1.340580 -1.750114
C -1.047824 -2.517434 -0.341253
C 3.826358 -0.443055 0.710454
C -0.227842 -1.767779 -1.341414
C 3.123500 -1.540391 1.445035
C -2.483916 -2.163096 -0.009121
C 3.148551 0.242354 -0.453663
C -1.912824 2.135077 -0.500669
C -0.880706 2.324791 0.633048
C -3.258563 1.537720 0.001024
C 0.488783 2.875099 0.134037
C -3.084638 0.151542 0.592750
C 1.264822 1.815916 -0.627504
H -0.811055 -3.577324 -0.164869
H 4.605156 0.129301 1.229853
H -0.648551 -0.884719 -1.830713
H 0.574599 -2.289032 -1.876944
H 2.103862 -1.807636 1.140589
H 3.401235 -1.741819 2.486489
H -2.675147 -2.260897 1.075317
H -3.169678 -2.820267 -0.573686
H 2.467165 -0.447142 -0.978274
H 3.877172 0.649507 -1.177304
H -1.494299 1.487913 -1.290580
H -2.126990 3.115510 -0.970246
H -1.282646 3.035421 1.381541
H -0.713506 1.367796 1.163358
H -3.698808 2.178951 0.783958
H -3.963688 1.476348 -0.847527
H 0.316758 3.735644 -0.539645
H 1.094975 3.213687 0.989883


