%chk=000150354.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150354

0 1
 O   -5.539700       2.088400     -3.0000001E-04
 O    5.539700       2.088300      3.0000001E-04
 O   -5.631900     -0.1049000     -6.9999998E-04
 O    5.631800     -0.1050000     -9.9999997E-05
 N   -4.985400      0.9665000     -1.9999999E-04
 N    4.985300      0.9665000     -1.9999999E-04
 C   -1.419000     -0.2950000      1.9999999E-04
 C    1.419000     -0.2950000       0.000000    
 C  -0.7159000      0.9390000      3.0000001E-04
 C   0.7159000      0.9390000      9.9999997E-05
 C  -0.7159000      -1.528900      9.9999997E-05
 C   0.7160000      -1.528900      9.9999997E-05
 C   -2.849000     -0.2951000      1.9999999E-04
 C    2.849000     -0.2949000     -1.9999999E-04
 C   -1.491100       2.126500      3.0000001E-04
 C    1.491000       2.126600      1.9999999E-04
 C   -1.491000      -2.716600      1.9999999E-04
 C    1.491100      -2.716500      9.9999997E-05
 C   -3.559500      0.9065000      9.9999997E-05
 C    3.559500      0.9067000     -3.9999999E-04
 C   -3.559600      -1.496700      9.9999997E-05
 C    3.559600      -1.496400     -3.0000001E-04
 C   -2.883800       2.113500      9.9999997E-05
 C    2.883700       2.113600     -9.9999997E-05
 C   -2.883700      -2.703600      9.9999997E-05
 C    2.883800      -2.703500     -9.9999997E-05
 H   -1.024100       3.107800      3.0000001E-04
 H    1.024000       3.107800      3.9999999E-04
 H   -1.024800      -3.698100      1.9999999E-04
 H    1.025000      -3.698000      9.9999997E-05
 H   -4.611700      -1.707200      5.0000002E-04
 H    4.611700      -1.707100     -6.0000003E-04
 H   -3.389800       3.075600      9.9999997E-05
 H    3.389700       3.075600       0.000000    
 H   -3.431000      -3.642300      1.9999999E-04
 H    3.431100      -3.642100     -1.9999999E-04


%chk=000150354-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150354

0 1
O -5.540447 2.316889 0.000635
O 5.540325 2.317091 -0.000144
O -5.849554 0.070248 0.000000
O 5.849635 0.070485 -0.000544
N -5.075451 1.107345 -0.000056
N 5.075428 1.107507 0.000059
C -1.467685 -0.339812 0.000014
C 1.467697 -0.339788 0.000029
C -0.738801 0.905820 0.000025
C 0.738788 0.905831 0.000033
C -0.741036 -1.588647 0.000027
C 0.741064 -1.588635 0.000027
C -2.929499 -0.347285 -0.000005
C 2.929514 -0.347238 0.000025
C -1.465471 2.117602 0.000034
C 1.465435 2.117626 0.000047
C -1.470803 -2.795195 0.000044
C 1.470842 -2.795174 0.000026
C -3.597665 0.936033 -0.000011
C 3.597654 0.936101 0.000058
C -3.610738 -1.607329 0.000025
C 3.610761 -1.607281 0.000018
C -2.870257 2.134786 0.000024
C 2.870217 2.134835 0.000058
C -2.883722 -2.800141 0.000055
C 2.883759 -2.800102 0.000020
H -0.951077 3.079833 0.000046
H 0.951023 3.079847 0.000044
H -0.954646 -3.757515 0.000053
H 0.954696 -3.757500 0.000031
H -4.698584 -1.619840 0.000000
H 4.698605 -1.619783 0.000003
H -3.421319 3.077718 0.000029
H 3.421261 3.077779 0.000078
H -3.419079 -3.755029 0.000080
H 3.419128 -3.754984 0.000014


