%chk=000020401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020401

0 1
 O    3.926000     -0.2617000      1.7000000E-03
 O   -4.117100      0.7931000      1.3000000E-03
 O   -3.987100      -1.476200      1.3000000E-03
 N   -1.393400       1.066000     -3.9999999E-04
 C   0.2626000     -0.4288000     -8.9999998E-04
 C  -2.2600001E-02  0.9383000     -3.0000001E-04
 C  -0.9836000      -1.115500     -1.3000000E-03
 C   -1.982900     -0.1697000     -1.1000000E-03
 C    1.610200     -0.8403000     -8.9999998E-04
 C   0.9763000       1.918100      3.0000001E-04
 C    2.620100      0.1287000     -6.0000003E-04
 C    2.305700       1.486200       0.000000    
 C   -3.396800     -0.3738000      9.9999997E-05
 C    4.182400      -1.664300      7.9999998E-04
 H   -1.127400      -2.188000     -1.4000000E-03
 H   -1.889600       1.946700      1.9999999E-04
 H    1.793600      -1.908000     -1.0000000E-03
 H   0.7326000       2.975200      1.0000000E-03
 H    3.101800       2.227200      7.9999998E-04
 H    5.269800      -1.793600      1.7000000E-03
 H    3.805900      -2.142800     -0.9097000    
 H    3.804300      -2.144000      0.9099000    
 H   -5.083100      0.6219000      2.6000000E-03


%chk=000020401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020401

0 1
O 3.971004 -0.231311 -0.000144
O -4.146160 0.905738 -0.001771
O -4.131875 -1.434706 -0.000659
N -1.449712 1.088590 0.001395
C 0.221923 -0.475597 0.000758
C -0.066023 0.939619 0.001020
C -1.040004 -1.163106 0.000915
C -2.046532 -0.182413 0.001612
C 1.575779 -0.923353 0.000398
C 0.966529 1.909159 0.000952
C 2.591622 0.048414 0.000260
C 2.289661 1.451143 0.000535
C -3.493032 -0.355434 0.002246
C 4.365046 -1.640608 -0.000751
H -1.220176 -2.236178 0.000788
H -1.983359 1.956267 0.001765
H 1.798344 -1.993702 0.000213
H 0.749303 2.982133 0.001171
H 3.131387 2.150053 0.000404
H 5.464651 -1.633653 -0.001240
H 3.993428 -2.161586 -0.905189
H 3.994247 -2.162137 0.903706
H -5.128349 0.757371 -0.004283


