%chk=000006206.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006206

0 1
 O   -1.529500     -0.6438000     -3.3000000E-03
 O   -4.891100      0.3111000      6.8000001E-03
 O   -3.931300      -1.667900     -2.7999999E-03
 O    4.518400       1.174700     -2.6000000E-03
 N   -3.847400     -0.4049000      2.0000001E-03
 N    1.963700      0.1406000     -5.1000002E-03
 N    3.068200     -0.6402000     -8.2999999E-03
 C  -0.4399000      0.1447000     -2.6000000E-03
 C  -0.7501000       1.464300      2.0000001E-03
 C   -2.591100      0.2042000      1.0000000E-03
 C   -2.164600       1.512000      4.4000000E-03
 C   0.8517000     -0.5216000     -6.8000001E-03
 C    4.309800     -3.6100000E-02 -6.8000001E-03
 C    5.433100      -1.037000      2.2100000E-02
 H  -6.7199998E-02   2.301800      3.5999999E-03
 H   -2.789400       2.394000      8.2999999E-03
 H   0.8295000      -1.627500     -1.0700000E-02
 H    2.947000      -1.648300     -3.5999999E-03
 H    5.195500      -1.906300     -0.5979000    
 H    6.344800     -0.5741000     -0.3658000    
 H    5.600700      -1.361500       1.052500    


%chk=000006206-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006206

0 1
O -1.604740 -0.707724 -0.065636
O -4.956803 0.560383 -0.033979
O -4.168468 -1.600648 -0.153868
O 4.477106 1.212322 0.129881
N -4.000882 -0.320543 -0.074499
N 1.946806 0.018879 0.024919
N 3.114830 -0.697593 -0.001630
C -0.432624 0.077275 -0.003140
C -0.776689 1.436597 0.073825
C -2.667614 0.200737 -0.025384
C -2.203242 1.513132 0.059253
C 0.810510 -0.653262 -0.030249
C 4.370854 -0.032992 0.055596
C 5.560270 -0.985850 0.018842
H -0.063548 2.255189 0.132473
H -2.829176 2.400397 0.103954
H 0.733005 -1.754520 -0.096473
H 3.103980 -1.728029 -0.062321
H 5.283155 -2.051475 -0.058972
H 6.202351 -0.722431 -0.838953
H 6.161719 -0.841643 0.932761


