%chk=000076826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076826

0 1
 O    3.788200     -0.5783000      3.9999999E-04
 N   0.6823000       1.290200     -1.9999999E-04
 N   0.9685000     -0.9140000     -1.9999999E-04
 C  -0.5812000      0.7570000     -9.9999997E-05
 C  -0.3756000     -0.6199000     -1.9999999E-04
 C    1.573000      0.2531000     -9.9999997E-05
 C   -1.847400       1.343000      9.9999997E-05
 C   -1.488000      -1.478400     -9.9999997E-05
 C   -2.943300      0.4737000      3.0000001E-04
 C   -2.768900     -0.9121000      9.9999997E-05
 C    2.992300      0.3858000     -9.9999997E-05
 H   0.9113000       2.275400     -3.0000001E-04
 H   -1.980100       2.418900      1.9999999E-04
 H   -1.363200      -2.556400     -1.9999999E-04
 H   -3.949500      0.8855000      6.0000003E-04
 H   -3.640200      -1.562200      1.9999999E-04
 H    3.392100       1.414100     -3.9999999E-04


%chk=000076826-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076826

0 1
O 3.949686 -0.477675 -0.000436
N 0.715366 1.275413 0.000056
N 0.957467 -1.005420 0.000010
C -0.581112 0.762020 0.000073
C -0.405100 -0.672728 0.000036
C 1.610317 0.180902 0.000059
C -1.856823 1.368507 0.000121
C -1.539792 -1.523768 0.000027
C -2.965224 0.499471 0.000111
C -2.810196 -0.923273 0.000065
C 3.064880 0.413443 0.000087
H 0.977873 2.260620 0.000055
H -1.989735 2.455076 0.000148
H -1.411395 -2.610041 0.000005
H -3.976086 0.921845 0.000130
H -3.706598 -1.552514 0.000062
H 3.336771 1.503525 -0.000608


