%chk=000170652.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170652

0 1
 O    4.322800       1.210200      -1.301500    
 O   -5.533100     -0.5933000      0.2562000    
 C    2.712500      0.4503000      0.3720000    
 C    2.241700     -0.6252000     -0.6340000    
 C    4.213300      0.5407000     -3.5900000E-02
 C   0.7438000     -0.9708000     -0.5876000    
 C    3.305900      -1.713300     -0.5334000    
 C    4.614900     -0.9426000     -0.2481000    
 C  -0.1303000      0.2419000     -0.2315000    
 C    1.853300       1.665500      0.1304000    
 C   0.3541000      -2.170400      0.2778000    
 C    2.554000      4.4000000E-02   1.855600    
 C    5.134900       1.266300      0.9393000    
 C   0.5457000       1.540500     -0.1599000    
 C   -1.437800      6.2399998E-02  8.0499999E-02
 C   -1.127900      -2.489100      6.9799997E-02
 C   -2.036600      -1.280300      0.1103000    
 C   -2.387300       1.161900      0.5229000    
 C   -3.787700       1.051200     -0.1126000    
 C   -3.364200      -1.480200      0.1787000    
 C   -4.332200     -0.3535000      0.1419000    
 C   -4.715400       2.089900      0.5381000    
 C   -3.744600       1.293900      -1.629200    
 H    2.369500     -0.2028000      -1.647500    
 H   0.4822000      -1.241500      -1.623700    
 H    3.377700      -2.297200      -1.456700    
 H    3.110500      -2.411100      0.2871000    
 H    5.088100      -1.365500      0.6457000    
 H    5.312000      -1.059900      -1.085100    
 H    2.291400       2.653400      0.2343000    
 H   0.5427000      -1.975000       1.338900    
 H   0.9376000      -3.056700      4.9999999E-03
 H    2.920700      0.8361000       2.519400    
 H    1.508400     -0.1212000       2.133700    
 H    3.102900     -0.8698000       2.102200    
 H    4.800600       2.297800       1.094800    
 H    5.191700      0.7674000       1.911200    
 H    6.153000       1.326900      0.5374000    
 H  -3.5200000E-02   2.447700     -0.2806000    
 H   -1.437200      -3.225000      0.8226000    
 H   -1.243000      -2.969100     -0.9117000    
 H    5.254100       1.177900      -1.579500    
 H   -2.476600       1.093400       1.617300    
 H   -1.994400       2.161500      0.3171000    
 H   -3.784900      -2.480100      0.2201000    
 H   -4.326200       3.105700      0.4073000    
 H   -5.720200       2.059400      0.1012000    
 H   -4.824100       1.905000       1.613000    
 H   -4.749600       1.236700      -2.063700    
 H   -3.335600       2.284100      -1.858500    
 H   -3.133200      0.5492000      -2.150100    


%chk=000170652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170652

0 1
O 4.283827 1.301087 -1.276468
O -5.623955 -0.555651 0.375680
C 2.740900 0.443581 0.366756
C 2.275703 -0.644297 -0.653913
C 4.261643 0.540769 0.007565
C 0.768153 -1.000965 -0.593593
C 3.352003 -1.751069 -0.532581
C 4.671807 -0.953749 -0.247835
C -0.091042 0.229031 -0.216500
C 1.907536 1.680224 0.110399
C 0.338852 -2.215415 0.267861
C 2.559911 0.013495 1.853531
C 5.164958 1.266207 1.016389
C 0.566620 1.540596 -0.141563
C -1.446639 0.056682 0.057168
C -1.146272 -2.513597 -0.021896
C -2.041898 -1.282678 0.094679
C -2.375739 1.193423 0.468268
C -3.823661 1.066533 -0.088325
C -3.407592 -1.448795 0.257028
C -4.376277 -0.347080 0.223487
C -4.731029 2.144845 0.545140
C -3.825083 1.227691 -1.638926
H 2.436928 -0.157487 -1.635970
H 0.479750 -1.270673 -1.634966
H 3.421782 -2.363937 -1.448897
H 3.129691 -2.437831 0.304354
H 5.203985 -1.367043 0.628569
H 5.371453 -1.005119 -1.102876
H 2.371675 2.672182 0.158838
H 0.486623 -2.006865 1.343898
H 0.947916 -3.102796 0.013214
H 2.891499 0.816403 2.535809
H 1.495283 -0.175622 2.068134
H 3.131469 -0.901018 2.097964
H 4.835188 2.311792 1.153970
H 5.171940 0.767556 2.000852
H 6.210669 1.286672 0.651538
H -0.049556 2.440890 -0.246793
H -1.534193 -3.310527 0.639922
H -1.228481 -2.905618 -1.058460
H 5.219851 1.339315 -1.600137
H -2.433996 1.215759 1.577806
H -1.975268 2.175414 0.160517
H -3.834226 -2.453921 0.370172
H -4.404983 3.155616 0.236001
H -5.777466 1.994084 0.231420
H -4.704180 2.092403 1.649410
H -4.849655 1.110701 -2.034536
H -3.458722 2.235440 -1.912103
H -3.175006 0.480664 -2.129004


