%chk=000066477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066477

0 1
 O   -1.259600       2.671200      1.0000000E-03
 O   -1.259700      -2.671200      1.4000000E-03
 N    1.318100       2.813600      7.9999998E-04
 N    1.318200      -2.814100       0.000000    
 N    4.719600       1.997300     -1.5000000E-03
 N    4.720700      -1.996000     -6.9999998E-04
 C   5.8499999E-02  0.6981000      6.9999998E-04
 C   5.8499999E-02 -0.6984000      3.9999999E-04
 C   -2.487600      0.6982000     -9.9999997E-05
 C   -2.487700     -0.6981000      1.9999999E-04
 C   -1.214400       1.447400      7.9999998E-04
 C   -1.214700      -1.447400      7.9999998E-04
 C    1.272100       1.396200      6.9999998E-04
 C    1.271800      -1.396700     -9.9999997E-05
 C    2.479100      0.6964000      3.9999999E-04
 C    2.478900     -0.6971000     -9.9999997E-05
 C   -3.701100       1.396600     -7.9999998E-04
 C   -3.701200      -1.396400     -1.9999999E-04
 C   -4.908100      0.6969000     -1.5000000E-03
 C   -4.908200     -0.6966000     -1.2000001E-03
 C    3.723200       1.418700     -6.9999998E-04
 C    3.723700      -1.418400     -3.9999999E-04
 H   -3.731100       2.482800     -8.9999998E-04
 H   -3.731300      -2.482600       0.000000    
 H   -5.849300       1.239200     -2.2000000E-03
 H   -5.849300      -1.238800     -1.6000000E-03
 H    2.199200       3.308500      1.5000000E-03
 H   0.4650000       3.354200      1.5000000E-03
 H    2.199300      -3.308800      3.0000001E-04
 H   0.4650000      -3.354700      8.9999998E-04


%chk=000066477-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066477

0 1
O -1.251689 2.763446 -0.000089
O -1.252021 -2.763515 -0.000227
N 1.322253 2.822521 0.000407
N 1.322498 -2.822621 0.000170
N 4.759262 2.100482 -0.000287
N 4.759467 -2.100281 0.000711
C 0.048723 0.719444 0.000154
C 0.048711 -0.719614 0.000104
C -2.497043 0.711750 -0.000181
C -2.497084 -0.711725 -0.000227
C -1.223349 1.469178 0.000030
C -1.223444 -1.469251 -0.000045
C 1.291896 1.454129 0.000274
C 1.291964 -1.454247 0.000146
C 2.529813 0.706273 0.000336
C 2.529847 -0.706316 0.000247
C -3.728838 1.415862 -0.000340
C -3.728919 -1.415766 -0.000438
C -4.945929 0.710208 -0.000563
C -4.945968 -0.710043 -0.000615
C 3.761250 1.438161 0.000390
C 3.761293 -1.438200 0.000247
H -3.696893 2.509363 -0.000300
H -3.697038 -2.509269 -0.000474
H -5.895080 1.256204 -0.000693
H -5.895152 -1.255984 -0.000784
H 2.209417 3.326099 0.000495
H 0.399813 3.297037 0.000551
H 2.209737 -3.326076 0.000247
H 0.400103 -3.297246 0.000155


