%chk=000004668.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004668

0 1
 O   -4.052400       1.215700     -0.6763000    
 O   -4.240500      0.3133000       1.398900    
 C   0.7085000      -2.155000     -0.2081000    
 C  -0.7184000      -2.620900      0.1026000    
 C    1.776900      -3.186900      0.1696000    
 C   -1.792000      -1.627200     -0.3491000    
 C    3.195400      -2.745000     -0.2072000    
 C   -3.220500      -2.123100     -9.4700001E-02
 C    1.976500       1.978400      0.2019000    
 C    3.452700       2.130900     -0.1797000    
 C    1.116700       3.177900     -0.2106000    
 C    4.318000      0.9649000      0.3107000    
 C    3.585200      -1.432300      0.4082000    
 C  -0.3497000       3.123700      0.2247000    
 C   -4.320200      -1.153500     -0.5174000    
 C    3.929200     -0.3487000     -0.3033000    
 C   -1.170700       4.311000     -0.2533000    
 C   -4.194800      0.1769000      0.1829000    
 H   0.7882000      -1.931100      -1.279100    
 H   0.8844000      -1.216900      0.3300000    
 H  -0.8150000      -2.795400       1.181100    
 H  -0.8945000      -3.584400     -0.3915000    
 H    1.727200      -3.378800       1.248900    
 H    1.561200      -4.138600     -0.3309000    
 H   -1.627700     -0.6766000      0.1718000    
 H   -1.671700      -1.425900      -1.420700    
 H    3.277400      -2.699500      -1.300300    
 H    3.906100      -3.510000      0.1273000    
 H   -3.370800      -3.072200     -0.6235000    
 H   -3.329700      -2.341000      0.9754000    
 H    1.897000       1.840900       1.287300    
 H    1.558600       1.079800     -0.2652000    
 H    3.540300       2.227600      -1.269100    
 H    3.843900       3.059900      0.2528000    
 H    1.158600       3.277100      -1.302800    
 H    1.566100       4.091400      0.1994000    
 H    5.362700       1.168700      4.6799999E-02
 H    4.274800      0.9148000       1.405500    
 H    3.583100      -1.381000       1.494200    
 H  -0.4001000       3.071800       1.318700    
 H  -0.8052000       2.202300     -0.1576000    
 H   -4.275700     -0.9971000      -1.601400    
 H   -5.310900      -1.563500     -0.2935000    
 H    3.941200     -0.4043000      -1.389100    
 H   -1.174000       4.368500      -1.346300    
 H   -2.207000       4.218000      8.6400002E-02
 H  -0.7653000       5.248900      0.1392000    
 H   -3.979700       2.073300     -0.2057000    


%chk=000004668-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004668

0 1
O -3.780823 1.482078 -1.185392
O -3.734208 0.913759 1.063790
C 0.744352 -2.308999 -0.404658
C -0.697070 -2.613980 0.060154
C 1.818631 -3.211477 0.239587
C -1.725471 -1.628897 -0.539556
C 3.269233 -2.805655 -0.156790
C -3.167764 -1.862636 -0.039672
C 1.926424 1.976924 0.398219
C 3.328107 2.132291 -0.232541
C 0.909505 3.033621 -0.089598
C 4.326640 1.016400 0.193622
C 3.670187 -1.449958 0.391618
C -0.477926 2.885581 0.576398
C -4.179313 -0.840372 -0.622682
C 3.959131 -0.349413 -0.352085
C -1.514048 3.907963 0.061209
C -3.886264 0.564515 -0.129245
H 0.804126 -2.402196 -1.509691
H 0.981360 -1.251352 -0.171650
H -0.743970 -2.558772 1.167787
H -0.970890 -3.654684 -0.213397
H 1.719767 -3.170151 1.344372
H 1.644736 -4.267232 -0.052486
H -1.413054 -0.594799 -0.283604
H -1.701312 -1.696164 -1.647174
H 3.361108 -2.805074 -1.261305
H 3.967485 -3.579907 0.223570
H -3.499699 -2.882355 -0.316844
H -3.195073 -1.798992 1.065083
H 2.015637 2.035489 1.503558
H 1.536727 0.963623 0.173036
H 3.235833 2.133624 -1.338903
H 3.749336 3.119521 0.047313
H 0.799252 2.953589 -1.191815
H 1.305951 4.051618 0.109941
H 5.338137 1.296221 -0.168634
H 4.382813 0.975014 1.299777
H 3.699996 -1.367203 1.491081
H -0.370517 2.994736 1.674192
H -0.857538 1.857092 0.409642
H -4.165428 -0.848330 -1.725220
H -5.202641 -1.102456 -0.290727
H 3.916578 -0.429640 -1.451521
H -1.668652 3.799895 -1.031490
H -2.484251 3.784895 0.581649
H -1.175401 4.945989 0.238889
H -3.556341 2.383057 -0.819906


