%chk=000178706.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178706

0 1
 O  -5.7999999E-03   1.269300      -1.780800    
 O  -0.6573000       1.510100       1.833900    
 O   -2.525700       2.214500      -1.248900    
 O   -3.398700     -5.3300001E-02   1.362200    
 C   6.3699998E-02  0.8997000     -0.4009000    
 C  -0.8200000       1.819700      0.4526000    
 C  -0.4632000     -0.5129000     -0.2871000    
 C   -2.312100       1.661300      5.0500002E-02
 C   -2.838500      0.1963000      6.9700003E-02
 C    1.531200      0.6915000     -9.3000002E-02
 C   -1.794300     -0.8671000     -0.1587000    
 C   0.5899000      -1.441100     -0.1933000    
 C    1.827300     -0.6980000     -5.8800001E-02
 C   -2.075000      -2.236800     -0.1112000    
 C   0.3103000      -2.792600     -0.1310000    
 C    2.522400       1.642900      7.2800003E-02
 C    3.123800      -1.136600      0.1469000    
 C   -1.033900      -3.187300     -0.1196000    
 C    3.828900       1.197200      0.2805000    
 C    4.126800     -0.1768000      0.3144000    
 H  -0.5222000       2.864100      0.2970000    
 H   -2.913500       2.260300      0.7465000    
 H   -3.639800      6.9399998E-02 -0.6670000    
 H   -3.102400      -2.581900     -2.3900000E-02
 H  -0.8750000       1.014000      -2.133700    
 H    1.097500      -3.535500     -6.1500002E-02
 H    2.299200       2.703200      3.2000002E-02
 H   0.2622000       1.711800       2.076200    
 H    3.367300      -2.192900      0.1906000    
 H   -1.279900      -4.244900     -6.3600004E-02
 H   -3.480700       2.182400      -1.428800    
 H   -2.698200      7.9400003E-02   2.024400    
 H    4.629200       1.920600      0.4129000    
 H    5.152800     -0.4962000      0.4787000    


%chk=000178706-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178706

0 1
O 0.079289 1.387572 -1.843167
O -0.815454 1.497243 1.826441
O -2.433991 2.053570 -1.431888
O -3.252248 0.029182 1.610173
C 0.052695 0.884792 -0.451130
C -0.848952 1.826747 0.387436
C -0.481106 -0.539390 -0.332244
C -2.339797 1.630824 -0.015726
C -2.849415 0.172839 0.193393
C 1.525452 0.688028 -0.078246
C -1.821342 -0.900776 -0.157591
C 0.578987 -1.478068 -0.234280
C 1.836984 -0.708494 -0.064222
C -2.122610 -2.288912 -0.089948
C 0.282344 -2.853389 -0.171632
C 2.525449 1.653272 0.101809
C 3.163872 -1.134855 0.141858
C -1.083631 -3.247232 -0.141720
C 3.859577 1.221526 0.328867
C 4.172203 -0.158732 0.343014
H -0.559875 2.882624 0.217600
H -2.965825 2.288495 0.617595
H -3.797267 0.035128 -0.360554
H -3.159334 -2.612671 0.055741
H -0.869095 1.625117 -2.079608
H 1.073093 -3.608587 -0.103712
H 2.290343 2.721837 0.044962
H 0.130557 1.408614 2.109503
H 3.419560 -2.200256 0.151048
H -1.334862 -4.312864 -0.097128
H -3.374026 2.027450 -1.734125
H -2.447209 0.279173 2.146845
H 4.654027 1.960165 0.481845
H 5.207908 -0.476170 0.508791


