%chk=000128391.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128391

0 1
 O    1.445900     -0.5239000       2.160300    
 O    1.598200      -3.057700      -1.106500    
 O    1.225600      -2.677800       1.376600    
 C    2.050000      0.5606000     -0.2824000    
 C    1.033900       1.459800     -0.5740000    
 C    1.780600     -0.8780000     -0.1209000    
 C    3.362400      0.9892000     -0.1335000    
 C    1.335300       2.814000     -0.7195000    
 C  -0.3544000       1.042200     -0.7371000    
 C    3.663700       2.343300     -0.2789000    
 C    2.650200       3.255600     -0.5720000    
 C   -1.276000       1.009500      0.2509000    
 C   -2.683400      0.6063000      8.2599998E-02
 C    1.455200      -1.489600       1.200600    
 C    1.835200      -1.709600      -1.173300    
 C   -3.043800     -0.1555000      -1.017100    
 C   -3.618700      0.9969000       1.027200    
 C   -4.376000     -0.5371000      -1.176700    
 C   -4.950800      0.6152000      0.8675000    
 C   -5.329300     -0.1518000     -0.2344000    
 C    1.136300     -0.9685000       3.485200    
 C    1.059800      -3.543200      -2.324700    
 H    4.163600      0.2912000      9.5899999E-02
 H   0.5584000       3.539700     -0.9487000    
 H  -0.6042000      0.7779000      -1.760800    
 H    4.687300       2.687400     -0.1638000    
 H    2.885000       4.309900     -0.6853000    
 H  -0.9852000       1.312500       1.255000    
 H    2.081200      -1.364400      -2.170500    
 H   -2.332400     -0.4970000      -1.762200    
 H   -3.339300       1.595300       1.890200    
 H   -4.670400      -1.138800      -2.031700    
 H   -5.693400      0.9150000       1.601100    
 H   -6.366300     -0.4500000     -0.3579000    
 H   0.1302000      -1.397600       3.514000    
 H    1.167200     -0.1013000       4.150200    
 H    1.878600      -1.697700       3.823300    
 H    1.789700      -3.460800      -3.137600    
 H   0.1360000      -3.015200      -2.587100    
 H   0.8194000      -4.602400      -2.192600    


%chk=000128391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128391

0 1
O 1.154169 -0.988595 1.870411
O 2.236533 -3.204099 -1.550071
O 0.404047 -2.833462 0.658111
C 2.031892 0.378668 -0.405984
C 0.951972 1.321735 -0.287092
C 1.788507 -1.098915 -0.415603
C 3.360795 0.859078 -0.533807
C 1.265747 2.711025 -0.293377
C -0.439131 0.845372 -0.204939
C 3.648661 2.240510 -0.543180
C 2.590711 3.170877 -0.417122
C -1.526985 1.571562 0.203531
C -2.916640 1.092158 0.291600
C 1.051742 -1.757335 0.698214
C 2.285972 -1.827836 -1.469986
C -3.299260 -0.261484 0.047862
C -3.938550 2.018663 0.651570
C -4.645968 -0.660211 0.152433
C -5.287409 1.619625 0.755142
C -5.649694 0.276025 0.504679
C 0.384840 -1.497648 3.026585
C 2.712898 -3.787138 -2.817624
H 4.179436 0.132225 -0.585625
H 0.452421 3.442442 -0.235217
H -0.595247 -0.199077 -0.504049
H 4.683996 2.586363 -0.636174
H 2.798271 4.246790 -0.424342
H -1.379421 2.614848 0.518862
H 2.780014 -1.303667 -2.303977
H -2.542138 -1.009126 -0.213628
H -3.664258 3.062931 0.848416
H -4.916962 -1.705390 -0.035507
H -6.053765 2.352530 1.031602
H -6.695584 -0.040083 0.585755
H -0.696793 -1.460822 2.809105
H 0.642440 -0.821166 3.853603
H 0.671924 -2.538150 3.254668
H 3.739340 -3.444537 -3.051548
H 2.028225 -3.526860 -3.645518
H 2.708550 -4.874228 -2.656378


