%chk=000159322.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159322

0 1
 O   -3.153500     -0.1542000     -0.2566000    
 O   -1.865100      -1.970400      0.3533000    
 O   -5.606000       1.001500      0.4563000    
 C    3.042800     -0.3104000      7.6200001E-02
 C    4.263100      0.5925000     -0.1267000    
 C    1.709800      0.4114000     -0.1363000    
 C    5.596600     -0.1348000      6.0699999E-02
 C   0.5267000     -0.5411000      6.6900000E-02
 C    6.776600      0.8275000     -8.1299998E-02
 C  -0.8182000      0.1410000     -0.1676000    
 C    8.103200      0.1188000      0.1417000    
 C   -1.983300     -0.8000000      1.3900000E-02
 C   -4.338600     -0.9452000     -0.1224000    
 C   -5.545300     -8.9000002E-02 -0.4550000    
 C   -6.708900       1.852500      0.1769000    
 H    3.108600      -1.158500     -0.6167000    
 H    3.071000     -0.7276000       1.090500    
 H    4.227400       1.025000      -1.134300    
 H    4.204200       1.430400      0.5792000    
 H    1.676600      0.8279000      -1.150100    
 H    1.630400       1.252100      0.5631000    
 H    5.620700     -0.6012000       1.053100    
 H    5.682600     -0.9409000     -0.6779000    
 H   0.5581000     -0.9498000       1.084900    
 H   0.6255000      -1.395400     -0.6150000    
 H    6.771100       1.277900      -1.080600    
 H    6.681300       1.644300      0.6437000    
 H  -0.9387000      0.9714000      0.5370000    
 H  -0.8557000      0.5346000      -1.189700    
 H    8.245000     -0.6860000     -0.5866000    
 H    8.153300     -0.3135000       1.146100    
 H    8.932800      0.8247000      3.4000002E-02
 H   -4.407700      -1.298100      0.9131000    
 H   -4.288300      -1.801600     -0.8037000    
 H   -5.449800      0.3046000      -1.473600    
 H   -6.460200     -0.6869000     -0.3805000    
 H   -6.709100       2.666500      0.9067000    
 H   -7.650600       1.302500      0.2672000    
 H   -6.617800       2.282600     -0.8251000    


%chk=000159322-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159322

0 1
O -3.192500 -0.217082 -0.367640
O -2.002511 -1.949507 0.637344
O -5.798150 0.937119 0.545923
C 3.095387 -0.365219 0.050831
C 4.294268 0.595303 -0.118551
C 1.728174 0.325306 -0.152675
C 5.663637 -0.091223 0.085188
C 0.533027 -0.635422 0.030932
C 6.861360 0.872337 -0.080531
C -0.819082 0.072053 -0.183725
C 8.225660 0.179874 0.127865
C -2.015344 -0.826212 0.083178
C -4.454870 -0.959926 -0.099292
C -5.610079 -0.062208 -0.505300
C -6.822920 1.918665 0.199736
H 3.193334 -1.205050 -0.668324
H 3.129306 -0.818571 1.063450
H 4.259712 1.049486 -1.131293
H 4.195331 1.434770 0.601400
H 1.693528 0.773637 -1.168107
H 1.636312 1.169388 0.563065
H 5.699505 -0.546915 1.097029
H 5.766301 -0.929113 -0.635917
H 0.555842 -1.077894 1.044839
H 0.622635 -1.484028 -0.675093
H 6.825917 1.325913 -1.092320
H 6.755943 1.710017 0.638950
H -0.906572 0.947856 0.491230
H -0.905872 0.477241 -1.209612
H 8.364469 -0.646099 -0.595229
H 8.300179 -0.250235 1.144629
H 9.065121 0.887667 -0.001993
H -4.509599 -1.214696 0.973372
H -4.444256 -1.896048 -0.687402
H -5.391383 0.423982 -1.481253
H -6.531221 -0.678935 -0.618540
H -6.879543 2.616641 1.049439
H -7.815963 1.441533 0.049626
H -6.554483 2.480694 -0.720431


