%chk=000141954.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141954

0 1
 O   -3.660500       1.200000      0.6436000    
 O    8.179700     -0.6145000     -0.5831000    
 C   -6.860700     -0.4136000     -0.4840000    
 C   -8.180600     -0.7752000      0.2028000    
 C   -5.847200      0.2409000      0.4535000    
 C   -9.185600      -1.452600     -0.7297000    
 C   -4.565400      0.6117000     -0.2806000    
 C   -10.50340      -1.725200     -2.0199999E-02
 C   -2.323400       1.041000      0.3867000    
 C   -1.421000      0.9978000       1.442900    
 C   -1.884700      0.9244000     -0.9269000    
 C   0.3880000      0.7180000     -0.1336000    
 C  -6.0300000E-02  0.8358000       1.181800    
 C  -0.5241000      0.7622000      -1.188100    
 C    1.806500      0.5482000     -0.4063000    
 C    4.160100     -7.7900000E-02  0.2058000    
 C    2.726200      0.1128000      0.4872000    
 C    4.730400      0.5676000     -0.8791000    
 C    4.909600     -0.8995000       1.032000    
 C    6.855800     -0.4377000     -0.3229000    
 C    6.087600      0.3864000      -1.145400    
 C    6.266800      -1.080600      0.7658000    
 C    8.906200      -1.470200      0.2978000    
 H   -6.421200      -1.322300     -0.9138000    
 H   -7.069300      0.2636000      -1.321700    
 H   -8.627200      0.1382000      0.6153000    
 H   -7.974300      -1.437500       1.052800    
 H   -6.278800       1.140400      0.9096000    
 H   -5.611400     -0.4343000       1.285400    
 H   -9.372200     -0.8141000      -1.600900    
 H   -8.769600      -2.396100      -1.101000    
 H   -4.155100     -0.3066000     -0.7209000    
 H   -4.783900       1.332000      -1.077500    
 H   -11.20720      -2.211700     -0.7026000    
 H   -10.35570      -2.383400      0.8419000    
 H   -10.95990     -0.7944000      0.3316000    
 H   -1.766500       1.093900       2.468300    
 H   -2.557900      0.9821000      -1.776700    
 H   0.6126000      0.8298000       2.034100    
 H  -0.1930000      0.6768000      -2.220400    
 H    2.095100      0.7700000      -1.430100    
 H    2.432400     -0.1621000       1.496600    
 H    4.177600       1.235500      -1.532000    
 H    4.464300      -1.408400       1.882900    
 H    6.542600      0.8935000      -1.992000    
 H    6.804300      -1.734100       1.444300    
 H    9.941700      -1.495800     -5.7399999E-02
 H    8.928000      -1.072400       1.318100    
 H    8.530200      -2.498300      0.2610000    


%chk=000141954-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000141954

0 1
O -3.665207 -0.344607 0.884711
O 8.565104 -0.001023 -0.760196
C -7.214340 -0.273361 -0.517401
C -8.603051 -0.393578 0.149700
C -6.053039 -0.359583 0.499640
C -9.772235 -0.307360 -0.857645
C -4.685500 -0.249234 -0.176974
C -11.156131 -0.433511 -0.184904
C -2.316873 -0.280518 0.505807
C -1.378546 -0.375648 1.567949
C -1.855713 -0.132828 -0.825781
C 0.493887 -0.179864 -0.030667
C -0.003385 -0.325847 1.302192
C -0.468033 -0.085571 -1.074803
C 1.922888 -0.124832 -0.366134
C 4.408290 -0.143746 0.168767
C 2.979514 -0.195939 0.506593
C 4.903090 -0.013222 -1.166784
C 5.371923 -0.227515 1.211952
C 7.216753 -0.055027 -0.374324
C 6.277511 0.030706 -1.436401
C 6.759750 -0.185415 0.959686
C 9.574611 -0.089372 0.296976
H -7.105440 -1.075486 -1.277375
H -7.156879 0.688973 -1.068228
H -8.715707 0.406305 0.910883
H -8.664308 -1.356074 0.699093
H -6.147110 0.447772 1.251040
H -6.102550 -1.318452 1.050500
H -9.711976 0.655820 -1.404644
H -9.656109 -1.105146 -1.619686
H -4.537247 -1.070392 -0.909804
H -4.579639 0.721175 -0.706439
H -11.974179 -0.368831 -0.925674
H -11.253774 -1.401165 0.342613
H -11.310026 0.370335 0.559575
H -1.757875 -0.488275 2.588465
H -2.555659 -0.054698 -1.662672
H 0.696044 -0.401954 2.141672
H -0.118561 0.027848 -2.108874
H 2.136330 -0.014694 -1.439325
H 2.766641 -0.304230 1.580047
H 4.202207 0.053783 -2.005771
H 5.024143 -0.328355 2.247892
H 6.655561 0.130216 -2.458694
H 7.462115 -0.254420 1.795768
H 10.541777 -0.027920 -0.223108
H 9.482396 0.749947 1.013821
H 9.504160 -1.051089 0.841864


