%chk=000168722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168722

0 1
 O   -2.232700       1.860400      0.8498000    
 O    1.679800       1.355400      0.2299000    
 O   -2.677000      -1.113200       1.688600    
 O    3.960300       1.730100      0.3468000    
 C  -0.5396000      0.2040000      0.2089000    
 C   -1.325100       1.424400     -0.1824000    
 C   -1.235900      -1.100000     -0.3160000    
 C   -2.824200       1.346400     -0.3427000    
 C   0.9193000      0.2374000     -0.2439000    
 C   -2.684000      -1.136400      0.2587000    
 C   -3.555700      4.4399999E-02 -0.2055000    
 C  -0.4183000      -2.344100      0.1598000    
 C    1.645600     -0.9539000      0.3556000    
 C    1.087100      -2.265000     -0.1727000    
 C  -0.6462000       2.563000     -0.8599000    
 C   -1.316300      -1.155100      -1.865900    
 C    3.031300     -0.4978000      9.4800003E-02
 C    3.005600      0.9848000      0.2271000    
 C    4.126100      -1.184800     -0.2310000    
 H  -0.5167000      0.1888000       1.308300    
 H   -3.343700       2.049300     -0.9802000    
 H   0.9820000      0.2512000      -1.341000    
 H   -3.176800      -2.073700     -2.4900001E-02
 H   -4.407400      0.1843000      0.4709000    
 H   -3.971600     -0.1999000      -1.190700    
 H  -0.8353000      -3.260000     -0.2770000    
 H  -0.5172000      -2.451300       1.247900    
 H    1.527300     -0.9531000       1.450700    
 H    1.604800      -3.111800      0.2932000    
 H    1.250800      -2.355900      -1.252200    
 H  -0.1017000       2.239300      -1.751800    
 H   -1.366800       3.317500      -1.198400    
 H   3.7000000E-02   3.082300     -0.1815000    
 H   -1.803100     -0.2753000      -2.296300    
 H  -0.3329000      -1.227300      -2.337600    
 H   -1.888500      -2.033400      -2.187700    
 H   -2.510300     -0.2035000       1.986300    
 H    4.096700      -2.264500     -0.3301000    
 H    5.075800     -0.6909000     -0.4061000    


%chk=000168722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168722

0 1
O -2.370573 1.783000 0.996423
O 1.765225 1.405246 0.034728
O -2.621680 -0.990594 1.749033
O 4.076223 1.737265 0.187303
C -0.533280 0.251077 0.148882
C -1.401976 1.489276 -0.172353
C -1.210484 -1.097152 -0.331443
C -2.891033 1.309321 -0.354632
C 0.911824 0.223540 -0.353402
C -2.653946 -1.133315 0.284206
C -3.561830 -0.051681 -0.342883
C -0.412869 -2.333844 0.191074
C 1.670164 -0.968270 0.284781
C 1.097195 -2.314089 -0.173282
C -0.756157 2.743535 -0.727764
C -1.324298 -1.175533 -1.881365
C 3.109457 -0.560098 0.057393
C 3.121654 0.948701 0.095722
C 4.226055 -1.302661 -0.130803
H -0.477265 0.206798 1.255570
H -3.423902 2.105257 -0.894919
H 0.959389 0.172485 -1.458481
H -3.085446 -2.136374 0.107703
H -4.505046 0.003469 0.233819
H -3.834596 -0.325195 -1.379326
H -0.883316 -3.251312 -0.214679
H -0.527391 -2.375192 1.291602
H 1.487573 -0.885560 1.380856
H 1.612312 -3.151873 0.333716
H 1.255994 -2.452029 -1.260458
H -0.313492 2.546044 -1.722197
H -1.509251 3.543380 -0.830814
H 0.056441 3.094089 -0.072931
H -1.660497 -0.223028 -2.328000
H -0.363445 -1.441977 -2.354120
H -2.050792 -1.959533 -2.168587
H -2.567671 -0.009989 1.940384
H 4.196326 -2.397678 -0.149545
H 5.196905 -0.813405 -0.269410


