%chk=000166874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166874

0 1
 O  -0.3457000       2.619100      -1.076300    
 O   0.8583000      -1.321500       1.609200    
 C    1.500400      0.2337000     -0.1159000    
 C    3.006000      0.1177000      0.1113000    
 C   0.9292000       1.466600      0.5903000    
 C   -1.670700       1.446700      0.5701000    
 C  -0.3639000       1.910900     -6.8400003E-02
 C   0.8368000      -1.037000      0.4099000    
 C   -2.704800       1.040000     -0.4938000    
 C   0.1717000      -1.950500     -0.6082000    
 C   -2.300900     -0.1908000      -1.318300    
 C    3.562600      -1.114400     -0.5985000    
 C    3.719800       1.380600     -0.3657000    
 C   -1.247600      -2.235100     -0.1931000    
 C   -2.204400       2.582400       1.440100    
 C   -2.302800      -1.459800     -0.5114000    
 C   -1.444300      -3.488600      0.6187000    
 H    1.304200      0.3130000      -1.192400    
 H    3.216700     -6.0000003E-04   1.182800    
 H    1.576700       2.344900      0.5436000    
 H   0.7461000       1.287100       1.655800    
 H   -1.463100      0.5883000       1.217500    
 H   -2.872000       1.875600      -1.185800    
 H   -3.669800      0.8454000     -7.7000000E-03
 H   0.7589000      -2.873700     -0.6728000    
 H   0.2101000      -1.507800      -1.607200    
 H   -1.341300     -1.1900000E-02  -1.810600    
 H   -3.030300     -0.3177000      -2.128300    
 H    4.653000      -1.157800     -0.4990000    
 H    3.172900      -2.044600     -0.1741000    
 H    3.327500      -1.099300      -1.668400    
 H    3.371300       1.694600      -1.355500    
 H    4.800000       1.208100     -0.4380000    
 H    3.599400       2.214100      0.3318000    
 H   -1.466800       2.875300       2.195200    
 H   -2.431700       3.471100      0.8407000    
 H   -3.118500       2.278700       1.960700    
 H   -3.287800      -1.764700     -0.1601000    
 H   -2.492800      -3.647600      0.8922000    
 H  -0.8657000      -3.441700       1.546300    
 H   -1.115700      -4.363600      4.8300002E-02


%chk=000166874-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166874

0 1
O -0.589749 2.065198 -1.571670
O 0.848673 -1.336168 1.420170
C 1.653156 0.236587 -0.255267
C 3.117405 0.133665 0.276331
C 0.918041 1.531697 0.250722
C -1.692868 1.351543 0.501697
C -0.474906 1.678962 -0.373965
C 0.814861 -0.972631 0.213172
C -2.952718 1.017698 -0.329121
C -0.072228 -1.678096 -0.832881
C -2.814920 -0.243292 -1.234902
C 3.794537 -1.142717 -0.284821
C 3.962942 1.379548 -0.075603
C -1.397799 -2.195089 -0.281722
C -1.949561 2.564613 1.447196
C -2.577984 -1.533672 -0.472080
C -1.321546 -3.480973 0.519986
H 1.668635 0.271942 -1.362967
H 3.057445 0.034788 1.378694
H 1.516011 2.406758 -0.057533
H 0.862909 1.492187 1.353819
H -1.427334 0.482964 1.139083
H -3.193638 1.884119 -0.974698
H -3.801772 0.879491 0.370038
H 0.537217 -2.528442 -1.213937
H -0.216566 -0.997812 -1.689425
H -2.018065 -0.053409 -1.976047
H -3.755474 -0.342803 -1.812237
H 4.825229 -1.237392 0.102560
H 3.247407 -2.057992 0.005120
H 3.852776 -1.106028 -1.390184
H 3.946322 1.578740 -1.164684
H 5.015973 1.217394 0.219478
H 3.615225 2.289308 0.444775
H -1.060488 2.816354 2.053541
H -2.235719 3.458304 0.863347
H -2.775653 2.325708 2.140573
H -3.475368 -1.976867 -0.012102
H -2.314225 -3.788626 0.892368
H -0.641964 -3.351468 1.382536
H -0.913220 -4.308893 -0.094360


