%chk=000122797.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122797

0 1
 O   -1.602800       3.638900      0.4628000    
 O    2.451000       3.228200      0.6052000    
 O   -2.352300       2.605200      -1.452600    
 O    3.882900      -2.469800      -1.423700    
 O    5.140000      -1.412000      0.3379000    
 O   -1.612000      -2.422700       2.236600    
 O   -4.284200      -1.364800      -1.594800    
 O   -3.944200      -2.751600      0.7779000    
 C   0.2406000       2.301000      0.8865000    
 C  -0.1148000       2.163200     -0.5837000    
 C   9.6000001E-02  0.7249000      -1.079900    
 C    1.735100       2.097000       1.100100    
 C    1.478700      0.2164000     -0.6502000    
 C  -0.3704000       3.644500       1.207700    
 C    2.225900      0.8442000      0.3939000    
 C   -1.489000       2.784100     -0.6092000    
 C  -0.9777000     -0.1989000     -0.5856000    
 C    2.006000     -0.9160000      -1.301800    
 C    3.480300      0.3247000      0.7646000    
 C    3.237200      -1.391200     -0.9022000    
 C    3.953000     -0.7890000      0.1027000    
 C   -2.144600     -0.3557000      -1.325000    
 C  -0.7965000     -0.8900000      0.6073000    
 C   -1.795100      -1.748800       1.066600    
 C   -3.143300      -1.214300     -0.8657000    
 C    5.087700      -2.478600     -0.6313000    
 C   -2.968600      -1.911000      0.3300000    
 C   -2.057800      -1.781700       3.430000    
 C   -5.361100     -0.4760000      -1.304000    
 H  -0.3065000       1.557200       1.478900    
 H   0.5197000       2.830900      -1.186300    
 H   7.8000002E-02  0.7406000      -2.178900    
 H    1.933600       2.025400       2.175600    
 H  -0.5929000       3.749300       2.273400    
 H   0.2274000       4.500700      0.8795000    
 H    1.457400      -1.409200      -2.098200    
 H    4.067600      0.7909000       1.549400    
 H    2.724700       3.056000     -0.3116000    
 H   -2.279700      0.1638000      -2.269900    
 H   9.2299998E-02 -0.7865000       1.221200    
 H    5.153600      -3.436700     -0.1030000    
 H    5.949800      -2.386100      -1.301900    
 H   -4.662000      -2.771700      0.1219000    
 H   -1.521000     -0.8399000       3.582500    
 H   -1.848000      -2.444500       4.274000    
 H   -3.136000      -1.597200       3.389200    
 H   -6.209000     -0.7456000      -1.939700    
 H   -5.072900      0.5567000      -1.524300    
 H   -5.666700     -0.5645000     -0.2566000    


%chk=000122797-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122797

0 1
O -1.572240 3.873089 0.271035
O 2.398369 3.459442 0.255832
O -2.371160 2.792304 -1.623029
O 3.936083 -2.434090 -1.506756
O 5.279912 -1.273424 0.108725
O -1.367694 -2.503846 2.515702
O -4.681950 -1.156573 -0.766726
O -4.105410 -2.611789 1.353721
C 0.280948 2.447308 0.824024
C -0.132027 2.203802 -0.638678
C 0.004917 0.708749 -1.021763
C 1.796598 2.278596 0.938665
C 1.441630 0.277389 -0.678419
C -0.321701 3.834479 1.112699
C 2.245083 0.973413 0.274222
C -1.477549 2.914786 -0.766577
C -1.057573 -0.193264 -0.365361
C 1.947667 -0.893831 -1.315585
C 3.554163 0.502521 0.606341
C 3.228416 -1.325825 -0.982370
C 4.020416 -0.641597 -0.034124
C -2.357590 -0.236163 -0.937390
C -0.791481 -0.948639 0.796366
C -1.788884 -1.754122 1.406034
C -3.346833 -1.021118 -0.327485
C 5.176606 -2.526133 -0.690564
C -3.082344 -1.801747 0.833369
C -2.316560 -2.720950 3.627399
C -5.106009 -0.327198 -1.900541
H -0.208853 1.690122 1.465637
H 0.569199 2.782744 -1.279788
H -0.126456 0.629504 -2.119131
H 2.125726 2.289891 1.998327
H -0.647677 3.990349 2.152065
H 0.340362 4.650739 0.780800
H 1.334345 -1.443873 -2.034747
H 4.163365 1.014619 1.358592
H 3.340303 3.248162 0.032842
H -2.580188 0.370554 -1.818608
H 0.201131 -0.958425 1.255915
H 5.090886 -3.386342 -0.001225
H 6.044837 -2.593807 -1.363688
H -4.910280 -2.467109 0.785036
H -2.671274 -1.751837 4.028271
H -1.729672 -3.251583 4.392782
H -3.179920 -3.322886 3.304816
H -6.180563 -0.526680 -2.023179
H -4.562743 -0.614491 -2.820493
H -4.936931 0.744578 -1.687690


