%chk=000068478.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068478

0 1
 O  -2.0600000E-02   2.537300      9.9999997E-05
 N    1.202300      0.5365000      1.9999999E-04
 N   4.6700001E-02  -1.552200      3.0000001E-04
 C   -1.232700      0.5388000       0.000000    
 C    1.149100     -0.8662000      1.9999999E-04
 C   -1.170100     -0.8574000      3.9999999E-04
 C   2.9899999E-02   1.309800      3.0000001E-04
 C    2.430300       1.191400      3.9999999E-04
 C   -2.466700       1.199300     -8.9999998E-04
 C    2.451800      -1.596000     -6.0000003E-04
 C   -2.364300      -1.587400      3.0000001E-04
 C    3.591900      0.5284000       0.000000    
 C    3.597500     -0.9073000     -5.0000002E-04
 C   -3.647800      0.4585000     -3.0000001E-04
 C   -3.597300     -0.9335000       0.000000    
 H    2.419100       2.275800      6.9999998E-04
 H   -2.528100       2.284000     -1.3000000E-03
 H    2.439100      -2.679600     -1.1000000E-03
 H   -2.340900      -2.674600      5.0000002E-04
 H    4.540000       1.053100       0.000000    
 H    4.554100      -1.417500     -1.0000000E-03
 H   -4.607500      0.9669000     -5.0000002E-04
 H   -4.517400      -1.510600      9.9999997E-05


%chk=000068478-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000068478

0 1
O 0.088203 2.596084 -0.000095
N 1.222463 0.530000 -0.000073
N 0.027058 -1.600637 -0.000108
C -1.229191 0.546027 -0.000086
C 1.172443 -0.907040 -0.000082
C -1.173852 -0.893556 -0.000084
C 0.001163 1.331981 -0.000071
C 2.443487 1.217437 -0.000088
C -2.485962 1.213981 -0.000119
C 2.442574 -1.591694 -0.000162
C -2.398140 -1.627871 -0.000119
C 3.643596 0.538863 -0.000133
C 3.644540 -0.903075 -0.000179
C -3.675908 0.473359 -0.000102
C -3.626501 -0.953657 -0.000117
H 2.334860 2.304901 -0.000073
H -2.489051 2.308885 -0.000109
H 2.384674 -2.682952 -0.000200
H -2.337383 -2.720135 -0.000108
H 4.578486 1.104521 -0.000137
H 4.594211 -1.447186 -0.000248
H -4.643159 0.986721 -0.000106
H -4.560209 -1.527460 -0.000099


