%chk=000145461.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145461

0 1
 O    1.830500     -0.7401000     -2.0000001E-03
 O    4.096600      -1.086500      1.9999999E-04
 N    1.812900       1.496900      1.9999999E-04
 N    3.131000       1.080100      3.9999999E-04
 N   -5.675100     -0.4245000      1.2000001E-03
 C  -0.3341000      0.2280000     -8.9999998E-04
 C    1.097800      0.4027000     -1.4000000E-03
 C   -1.172700       1.342700     -3.9999999E-04
 C  -0.8803000      -1.055500     -6.9999998E-04
 C   -2.557200       1.173800      3.9999999E-04
 C   -2.264800      -1.224500     -1.9999999E-04
 C   -3.103500     -0.1098000      3.0000001E-04
 C    3.093200     -0.2319000     -6.9999998E-04
 C   -4.521700     -0.2833000      7.9999998E-04
 C    5.447500     -0.5682000      2.7999999E-03
 H  -0.7689000       2.352300     -3.9999999E-04
 H  -0.2594000      -1.947800     -1.1000000E-03
 H   -3.198100       2.052400      7.9999998E-04
 H   -2.675800      -2.231300     -1.9999999E-04
 H    5.616800      2.9300001E-02  0.9039000    
 H    5.619800      3.1099999E-02 -0.8965000    
 H    6.134100      -1.418700      3.1000001E-03


%chk=000145461-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000145461

0 1
O 1.910423 -0.833690 0.000558
O 4.223231 -1.135960 0.000976
N 1.806864 1.456442 0.001156
N 3.194870 1.071435 0.001334
N -5.809473 -0.338012 -0.001050
C -0.365667 0.174110 0.000310
C 1.080949 0.333721 0.000677
C -1.191144 1.333724 0.000252
C -0.960555 -1.117081 0.000020
C -2.588245 1.203040 -0.000092
C -2.359684 -1.248591 -0.000326
C -3.185984 -0.090311 -0.000384
C 3.194292 -0.267310 0.000982
C -4.618589 -0.225107 -0.000737
C 5.573454 -0.503210 0.001440
H -0.720198 2.321227 0.000479
H -0.323556 -2.006345 0.000065
H -3.226133 2.091913 -0.000141
H -2.821002 -2.240602 -0.000550
H 5.691790 0.119071 0.903724
H 5.692185 0.119556 -0.900458
H 6.270773 -1.350819 0.001364


