%chk=000074618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074618

0 1
 O    3.797200      -1.156800     -7.0799999E-02
 O    2.077400       2.527400     -0.5153000    
 O    3.810800       1.527700      0.5629000    
 C   -1.846400     -0.6109000     -1.0600000E-02
 C   -2.362100      0.1529000      -1.242200    
 C   -2.350200      3.1500001E-02   1.293200    
 C   -3.884500      0.2807000      -1.222600    
 C   -3.872500      0.1602000       1.300200    
 C   -4.380000      0.9142000      7.4199997E-02
 C  -0.3314000     -0.7513000     -2.4700001E-02
 C   0.4718000      0.3858000      2.5000000E-02
 C   0.2465000      -2.017100     -8.8000000E-02
 C    1.860600      0.2563000      1.0900000E-02
 C    1.635400      -2.146400     -0.1019000    
 C    2.442400      -1.009800     -5.2400000E-02
 C    2.684900       1.455700      6.2100001E-02
 H   -2.278800      -1.621100     -5.6899998E-02
 H   -2.053100     -0.3614000      -2.160600    
 H   -1.926500       1.159000      -1.286900    
 H   -1.913800       1.028800       1.430100    
 H   -2.032900     -0.5684000       2.155300    
 H   -4.335400     -0.7125000      -1.339700    
 H   -4.214200      0.8832000      -2.076500    
 H   -4.193800      0.6785000       2.210600    
 H   -4.322900     -0.8397000       1.326300    
 H   -4.043200       1.957000      0.1224000    
 H   -5.475700      0.9318000      8.0300003E-02
 H   9.6000005E-03   1.367400      8.7099999E-02
 H  -0.3685000      -2.911900     -0.1275000    
 H    2.075000      -3.139000     -0.1523000    
 H    4.013500      -2.103800     -0.1173000    
 H    2.639600       3.330400     -0.4766000    


%chk=000074618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000074618

0 1
O 3.892521 -1.189190 -0.096555
O 1.944785 2.640142 0.017131
O 3.998530 1.568947 -0.043531
C -1.868418 -0.631210 -0.006015
C -2.399281 0.111216 -1.267733
C -2.369575 0.078767 1.285607
C -3.939535 0.250228 -1.246780
C -3.909956 0.217283 1.303371
C -4.426482 0.951484 0.043293
C -0.349357 -0.781679 -0.027855
C 0.500590 0.345998 -0.015099
C 0.261697 -2.061480 -0.065737
C 1.917982 0.240944 -0.037956
C 1.661956 -2.202889 -0.089059
C 2.502759 -1.062284 -0.075225
C 2.750680 1.470550 -0.024153
H -2.311752 -1.650671 -0.013853
H -2.071815 -0.426055 -2.178953
H -1.941461 1.120688 -1.313212
H -1.911616 1.087287 1.346652
H -2.021476 -0.481187 2.175256
H -4.399804 -0.758123 -1.308451
H -4.278400 0.810182 -2.140035
H -4.228405 0.753599 2.218365
H -4.368638 -0.792641 1.349273
H -4.055581 1.997606 0.052504
H -5.532505 1.003575 0.056877
H 0.080336 1.354988 0.012831
H -0.367834 -2.959403 -0.077145
H 2.111489 -3.204480 -0.118098
H 4.148916 -2.146461 -0.122082
H 2.558449 3.422668 0.024168


