%chk=000084628.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084628

0 1
 O   -1.771700       2.159200     -3.0000001E-04
 O    3.781100     -0.3523000       1.097700    
 O    3.781300     -0.3525000      -1.097600    
 O   -3.564900      6.8800002E-02   1.097700    
 O   -3.564900      6.8700001E-02  -1.097600    
 N  -0.6463000       1.552000      3.9999999E-04
 N    3.221600     -0.1294000      9.9999997E-05
 N   -3.000600     -0.1428000      9.9999997E-05
 C  -0.5180000      0.1618000      3.9999999E-04
 C   0.7670000     -0.4292000      3.0000001E-04
 C    1.897100      0.3979000       0.000000    
 C   -1.665700     -0.6424000      9.9999997E-05
 C   0.8670000      -1.829300      9.9999997E-05
 C    1.757000       1.781300     -3.9999999E-04
 C   -1.544300      -2.031200     -3.9999999E-04
 C   0.4866000       2.342300     -9.9999997E-05
 C  -0.2822000      -2.623000     -1.9999999E-04
 H    1.829300      -2.335400       0.000000    
 H    2.625000       2.435300     -7.9999998E-04
 H   -2.423300      -2.672000     -6.9999998E-04
 H   0.3048000       3.407700     -5.0000002E-04
 H  -0.1918000      -3.705500     -5.0000002E-04


%chk=000084628-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084628

0 1
O -1.845725 2.153381 -0.000390
O 3.825461 -0.403657 1.143604
O 3.827299 -0.399355 -1.143890
O -3.631434 0.032969 1.144844
O -3.631890 0.032194 -1.144747
N -0.640357 1.600639 -0.000277
N 3.284960 -0.160365 -0.000124
N -3.066309 -0.107352 -0.000016
C -0.517426 0.177983 -0.000125
C 0.787436 -0.434550 -0.000045
C 1.925923 0.432964 -0.000116
C -1.673279 -0.649670 -0.000099
C 0.883095 -1.862056 0.000057
C 1.783231 1.818280 -0.000217
C -1.558893 -2.043108 -0.000065
C 0.494095 2.383483 -0.000238
C -0.270679 -2.647654 0.000016
H 1.869942 -2.334740 0.000202
H 2.650444 2.482846 -0.000289
H -2.462209 -2.660092 -0.000070
H 0.303334 3.456467 -0.000292
H -0.192919 -3.738608 0.000078


