%chk=000167493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167493

0 1
 O  -9.0099998E-02   3.306800     -7.9300001E-02
 O    2.240300       3.858500     -0.1572000    
 O   -3.059000      -2.781300      0.2129000    
 O   -4.645100       1.675600      8.8200003E-02
 O    4.183600     -0.9604000       1.233700    
 O    4.283800      -1.168600      -1.027500    
 O    2.239200      -3.049300      -1.004500    
 O    2.293300      -2.969600       1.188600    
 N    1.869000      -2.559800      8.5500002E-02
 C   0.2202000      0.8477000      1.6000000E-03
 C    1.252500     -0.1338000      1.2400000E-02
 C   -1.163400      0.4131000      5.0700001E-02
 C   0.6837000       2.179900     -5.7999998E-02
 C   -1.445400     -0.9779000      0.1084000    
 C   0.9241000      -1.489200      7.0000000E-02
 C    2.618000      0.2324000     -3.4400001E-02
 C    2.024200       2.515300     -0.1032000    
 C  -0.4015000      -1.904500      0.1173000    
 C    3.014200       1.564400     -9.3000002E-02
 C   -2.289500       1.276500      4.5600001E-02
 C   -2.769900      -1.445600      0.1571000    
 C   -3.603300      0.7995000      9.4200000E-02
 C   0.8930000       4.353300     -0.1425000    
 C   -3.843800     -0.5630000      0.1500000    
 C    3.756100     -0.6868000     -2.5900001E-02
 C   -3.225100      -3.455300      -1.030200    
 C   -5.959100       1.122100      0.1394000    
 H  -0.6115000      -2.972400      0.1704000    
 H    4.059200       1.855500     -0.1291000    
 H   -2.169900       2.354200      3.4000000E-03
 H   0.7665000       5.007700      0.7275000    
 H   0.7227000       4.941800      -1.051300    
 H   -4.837100     -0.9970000      0.1915000    
 H   -3.342700      -4.523400     -0.8278000    
 H   -2.353400      -3.317500      -1.677800    
 H   -4.125800      -3.096300      -1.538400    
 H    4.945900      -1.577800       1.235100    
 H   -6.663400       1.960300      0.1253000    
 H   -6.130400      0.5771000       1.074000    
 H   -6.173200      0.5104000     -0.7436000    


%chk=000167493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167493

0 1
O -0.172203 3.241450 0.207619
O 2.100749 3.963130 0.320947
O -2.769835 -2.980463 -0.412585
O -4.465021 1.665026 -0.288340
O 5.157192 -0.157897 0.150739
O 3.861918 -1.567879 -1.157171
O 1.822925 -3.864889 0.284902
O 2.995716 -2.285685 1.430527
N 2.037365 -2.642202 0.634529
C 0.332864 0.750333 0.103279
C 1.444649 -0.193532 0.106065
C -1.055716 0.295456 -0.029347
C 0.693013 2.116821 0.199558
C -1.294749 -1.122652 -0.137096
C 1.084920 -1.601799 0.182360
C 2.800230 0.288111 0.036687
C 2.024995 2.549815 0.263070
C -0.217212 -2.045059 0.016417
C 3.097662 1.666973 0.149945
C -2.157101 1.187524 -0.079388
C -2.640943 -1.595025 -0.312453
C -3.463237 0.689536 -0.247837
C 0.703040 4.411194 0.508841
C -3.725499 -0.704666 -0.371086
C 3.930419 -0.599168 -0.363982
C -4.110623 -3.545909 -0.586966
C -5.853918 1.231957 -0.468515
H -0.426825 -3.115826 0.060057
H 4.130869 2.014984 0.114706
H -2.022223 2.265371 -0.000910
H 0.547806 4.706136 1.563560
H 0.478054 5.216170 -0.206379
H -4.744537 -1.072314 -0.505527
H -3.955478 -4.632649 -0.641675
H -4.574511 -3.186428 -1.525393
H -4.761716 -3.303098 0.274720
H 5.870464 -0.768728 -0.177900
H -6.442763 2.160387 -0.469746
H -6.184692 0.583277 0.365527
H -5.989145 0.704818 -1.432657


