%chk=000125006.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125006

0 1
 O  -3.2800000E-02   1.650800      7.1300000E-02
 O    2.099500       2.440100      0.1072000    
 O    3.572700      -1.300400       1.934900    
 O    3.747600       1.174500      -1.954600    
 N   -4.589600      0.1216000      1.0200000E-02
 N    3.210300     -2.6400000E-02 -6.6999998E-03
 C  -0.4430000     -0.7486000     -3.4299999E-02
 C   -3.209700     -0.1655000     -4.6000001E-03
 C    1.016700     -0.9827000     -4.6999998E-02
 C  -0.9166000      0.5603000      2.4000000E-02
 C    1.844500      8.0200002E-02 -3.0000001E-04
 C   -2.279800      0.8665000      3.9400000E-02
 C   -5.563900     -0.9512000     -3.5399999E-02
 C   -5.054100       1.493100      8.5100003E-02
 C   -1.400500      -1.774200     -7.7900000E-02
 C   -2.770400      -1.485300     -6.3199997E-02
 C    1.340800       1.476200      6.3400000E-02
 C    1.480300      -2.417600     -0.1122000    
 C   -5.750300      -1.427100      -1.463300    
 C   -5.009100       1.982000       1.520100    
 C    3.937600     -0.6930000      0.9418000    
 C    4.023200      0.5190000     -0.9633000    
 C    5.348100     -0.5534000      0.5448000    
 C    5.398600      0.1614000     -0.5796000    
 H   -2.550200       1.915500      8.3600000E-02
 H   -5.316200      -1.776800      0.6411000    
 H   -6.533500     -0.5865000      0.3286000    
 H   -4.510900       2.162200     -0.5915000    
 H   -6.095100       1.549800     -0.2593000    
 H   -1.110000      -2.820800     -0.1169000    
 H   -3.438400      -2.339000     -9.4599999E-02
 H    1.238600      -2.943700      0.8174000    
 H    2.554000      -2.522800     -0.2861000    
 H    1.005500      -2.940800     -0.9501000    
 H   -6.082000     -0.6054000      -2.107700    
 H   -4.835100      -1.835700      -1.900300    
 H   -6.514900      -2.209900      -1.500600    
 H   -5.626700       1.349600       2.167500    
 H   -3.998000       1.987200       1.936600    
 H   -5.399100       3.003200       1.580700    
 H    6.178700     -0.9698000       1.089600    
 H    6.278500      0.4435000      -1.132800    


%chk=000125006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125006

0 1
O 0.002296 1.598904 0.142753
O 2.149849 2.411815 0.320092
O 3.604030 -1.072841 2.150930
O 3.835480 0.823407 -2.152849
N -4.592280 0.110435 0.027289
N 3.310230 -0.135216 -0.026796
C -0.403853 -0.818347 -0.109726
C -3.232612 -0.185287 -0.012608
C 1.024132 -1.061100 -0.162078
C -0.884235 0.519609 0.031703
C 1.888662 0.022809 -0.035643
C -2.245860 0.842571 0.082864
C -5.623891 -0.949873 0.031685
C -5.079457 1.507141 0.069440
C -1.400345 -1.835240 -0.193165
C -2.764603 -1.543218 -0.150760
C 1.434761 1.404874 0.153394
C 1.550492 -2.467387 -0.334677
C -6.030088 -1.419526 -1.384349
C -5.158818 2.088173 1.500002
C 4.071444 -0.583034 1.096732
C 4.187024 0.370863 -1.041808
C 5.516281 -0.364307 0.733301
C 5.583182 0.194553 -0.505130
H -2.505889 1.894276 0.214345
H -5.273390 -1.805332 0.637339
H -6.511257 -0.548828 0.555813
H -4.436359 2.139812 -0.569005
H -6.083541 1.524317 -0.393835
H -1.089987 -2.879713 -0.297652
H -3.478392 -2.365537 -0.238393
H 1.408170 -3.049214 0.595219
H 2.625762 -2.465260 -0.568198
H 1.019978 -2.994003 -1.147454
H -6.434169 -0.578643 -1.976206
H -5.164892 -1.831949 -1.931599
H -6.809196 -2.201753 -1.323847
H -5.845036 1.492925 2.129048
H -4.168346 2.089597 1.986403
H -5.532526 3.128186 1.473192
H 6.323580 -0.636346 1.413597
H 6.458968 0.487787 -1.084360


