%chk=000100715.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100715

0 1
 O   -1.119700       1.564200     -0.1558000    
 O   -3.442400     -0.8227000      -1.138500    
 O    4.238800      0.8275000      0.8940000    
 O   -3.306300       1.979000     -0.6978000    
 O   -4.381800      0.1095000       1.333800    
 C    1.052400      0.6158000     -0.6001000    
 C  -0.2996000      0.4002000      0.1018000    
 C   -1.134900     -0.7625000     -0.4285000    
 C    1.888700     -0.6430000     -0.9179000    
 C   -2.565300     -0.2810000     -0.1709000    
 C    3.311200     -8.6199999E-02  -1.138900    
 C  -0.7984000      -2.106800      0.2263000    
 C    2.041600       1.505200      0.1378000    
 C    3.452700       1.144000     -0.2440000    
 C    1.729800      -1.792000      6.5399997E-02
 C   0.5449000      -2.696100     -0.1991000    
 C   -2.416800       1.203300     -0.3851000    
 C   -3.124500     -0.5333000       1.227400    
 C    1.750700       2.464600       1.028100    
 C    2.578700      -2.089600       1.061900    
 H   0.8596000       1.125200      -1.557500    
 H  -0.1693000      0.3286000       1.189300    
 H  -0.9972000     -0.8571000      -1.515800    
 H    1.567400      -1.034800      -1.894100    
 H   -1.579000      -2.834200     -3.0800000E-02
 H  -0.8098000      -2.010900       1.319500    
 H    4.093800     -0.8354000     -0.9795000    
 H    3.388700      0.2380000      -2.186000    
 H    3.937400       1.963000     -0.7866000    
 H   0.5144000      -2.952200      -1.265900    
 H   0.6742000      -3.654600      0.3210000    
 H   -2.473500     -0.1550000       2.022100    
 H   -3.299800      -1.600600       1.393300    
 H    2.540100       3.036900       1.504800    
 H   0.7320000       2.711300       1.301100    
 H   -4.336600     -0.4865000     -0.9561000    
 H    3.460700      -1.501900       1.274100    
 H    2.408100      -2.947100       1.705400    
 H    5.121800      0.5703000      0.5781000    
 H   -4.226600       1.067200       1.393800    


%chk=000100715-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100715

0 1
O -1.024619 1.653671 0.099510
O -3.349595 -0.562840 -1.311524
O 4.342077 0.824377 0.858660
O -3.284656 2.176800 0.034521
O -4.698721 -0.168996 1.055573
C 1.096156 0.630900 -0.632022
C -0.188776 0.386618 0.167665
C -1.114627 -0.746579 -0.354990
C 1.877911 -0.692509 -0.994202
C -2.551066 -0.209613 -0.143457
C 3.321606 -0.173204 -1.255603
C -0.820802 -2.120938 0.281345
C 2.134913 1.509329 0.070263
C 3.536237 1.082574 -0.361563
C 1.735219 -1.791909 0.068121
C 0.548806 -2.732836 -0.133954
C -2.370202 1.326412 -0.023030
C -3.316900 -0.663905 1.134068
C 1.893846 2.499273 0.961148
C 2.571850 -1.919685 1.132601
H 0.793392 1.112849 -1.587124
H 0.048429 0.245373 1.238399
H -1.001596 -0.821166 -1.454895
H 1.462955 -1.100061 -1.936471
H -1.621596 -2.826437 -0.014520
H -0.849046 -2.032011 1.385970
H 4.080315 -0.950461 -1.058570
H 3.409327 0.121963 -2.318703
H 4.036771 1.890116 -0.937240
H 0.490418 -3.029629 -1.201606
H 0.701737 -3.658281 0.451819
H -2.813268 -0.316605 2.059272
H -3.405849 -1.761336 1.153407
H 2.724320 3.039510 1.428354
H 0.876730 2.784243 1.249281
H -4.305261 -0.445619 -1.047073
H 3.395347 -1.218124 1.310638
H 2.428626 -2.723657 1.866045
H 5.291314 0.724493 0.588910
H -4.675522 0.828203 1.001079


