%chk=000155659.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155659

0 1
 O    2.802300      0.1337000     -0.2079000    
 O  -0.8716000      0.2388000     -0.6302000    
 O    1.219400      -4.438900     -7.9999998E-04
 O    5.838500      -3.423400      0.5201000    
 O    1.304300       4.447700       2.232200    
 O   -2.018200      -1.234500      0.7246000    
 O    1.161800       6.150300      3.9600000E-02
 C   0.3620000     -0.1983000     -6.9600001E-02
 C    1.529500      0.5492000     -0.7290000    
 C   0.5131000      -1.695600     -0.3244000    
 C    1.926300      -2.141300     -0.1004000    
 C    2.976200      -1.217200     -6.7599997E-02
 C    1.431800       2.048900     -0.5195000    
 C    2.212200      -3.504800      5.1199999E-02
 C    4.287400      -1.648000      0.1527000    
 C    1.412300       2.569300      0.7726000    
 C    1.360700       2.900000      -1.620100    
 C    3.523100      -3.934200      0.2591000    
 C    4.559800      -3.005600      0.3137000    
 C   -1.997300     -0.3676000     -0.1386000    
 C    1.321400       3.947800      0.9650000    
 C    1.269900       4.278400      -1.427800    
 C   -3.209400      0.2049000     -0.8342000    
 C    1.250200       4.802300     -0.1351000    
 C   -4.505400     -0.3769000     -0.3317000    
 C   -5.024800      -1.511000     -0.9386000    
 C   -5.159400      0.2307000      0.7301000    
 C   -6.224700      -2.049400     -0.4737000    
 C   -6.359300     -0.3076000       1.195300    
 C   -6.891900      -1.447600      0.5932000    
 H   0.3575000     -1.7899999E-02   1.014100    
 H    1.528000      0.3487000      -1.810100    
 H   0.2174000      -1.942800      -1.352300    
 H  -0.1221000      -2.280400      0.3451000    
 H    5.094200     -0.9197000      0.1918000    
 H    1.479200       1.909200       1.633500    
 H    1.374300       2.506600      -2.632800    
 H    3.744400      -4.991900      0.3804000    
 H    1.215000       4.932700      -2.293700    
 H   -3.113600      1.7700000E-02  -1.910600    
 H   -3.214200       1.292000     -0.6889000    
 H    1.605300      -5.322900      0.1237000    
 H    6.426300      -2.648500      0.5280000    
 H    1.360800       3.711100       2.864800    
 H   -4.511700      -1.988300      -1.768700    
 H   -4.751900       1.117500       1.207100    
 H    1.122000       6.580800     -0.8316000    
 H   -6.639100      -2.937400     -0.9418000    
 H   -6.878500      0.1604000       2.026500    
 H   -7.825900      -1.867000      0.9555000    


%chk=000155659-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155659

0 1
O 2.617224 -0.044918 0.155023
O -0.809325 -1.073749 -1.013578
O 2.839715 -4.735759 -1.109400
O 6.759149 -2.524455 0.717935
O -1.744369 2.999472 2.032550
O -1.923087 -1.333133 1.026530
O -1.041934 5.161931 0.569035
C 0.510800 -1.200011 -0.332464
C 1.344873 0.063038 -0.645878
C 1.215552 -2.449310 -0.876721
C 2.688282 -2.428379 -0.499224
C 3.312551 -1.263763 0.011227
C 0.717088 1.397027 -0.316394
C 3.487155 -3.595395 -0.595323
C 4.662907 -1.251837 0.430206
C -0.201026 1.555899 0.752031
C 1.062277 2.528495 -1.089496
C 4.837881 -3.624262 -0.193213
C 5.411175 -2.442032 0.326750
C -1.958686 -1.151254 -0.210455
C -0.788868 2.807420 1.026841
C 0.504158 3.792438 -0.801558
C -3.213184 -0.979756 -1.061506
C -0.426925 3.944466 0.249506
C -4.257843 -0.104904 -0.377266
C -5.498739 -0.640842 0.040986
C -3.985973 1.266436 -0.133895
C -6.454360 0.176865 0.688212
C -4.932832 2.084005 0.520503
C -6.173144 1.540401 0.931823
H 0.343300 -1.280795 0.756918
H 1.638525 0.040319 -1.716152
H 1.091373 -2.482775 -1.976986
H 0.739149 -3.364078 -0.482098
H 5.090877 -0.321130 0.817594
H -0.480052 0.698465 1.376793
H 1.771423 2.425036 -1.917999
H 5.451247 -4.528274 -0.267044
H 0.781324 4.665283 -1.406876
H -3.626465 -1.990190 -1.244323
H -2.910712 -0.569257 -2.040234
H 3.451674 -5.512709 -1.114006
H 7.070685 -1.658792 1.080820
H -2.030272 2.128672 2.408715
H -5.716807 -1.701833 -0.131632
H -3.031308 1.698382 -0.458897
H -0.706672 5.881175 -0.022843
H -7.411944 -0.251317 1.005349
H -4.698015 3.136905 0.711046
H -6.910220 2.172779 1.439265


