%chk=000086944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086944

0 1
 O    4.093600      -1.444900     -9.6000005E-03
 O   -2.853200      -1.395200      1.6000000E-03
 N   -1.891800      0.7531000     -1.3000000E-03
 N    4.514300      0.8093000      3.3000000E-03
 C  -0.5206000      0.4966000     -8.9999998E-04
 C    2.221800     -1.5400000E-02  1.8000000E-03
 C   0.3869000       1.556000     -2.6000000E-03
 C  -5.6699999E-02 -0.8190000      2.2000000E-03
 C    1.758000       1.300000     -1.3000000E-03
 C    1.314500      -1.075000      3.5999999E-03
 C    3.651300     -0.2827000      4.1999999E-03
 C   -2.943800     -0.1733000      1.9999999E-04
 C   -4.273100      0.5037000     -6.9999998E-04
 C   -5.401300     -0.2132000     -5.0000002E-04
 H   3.8600001E-02   2.585900     -4.9000001E-03
 H  -0.6957000      -1.690800      4.1000000E-03
 H    2.403600       2.169900     -3.1999999E-03
 H    1.652700      -2.108000      6.5000001E-03
 H   -2.141000       1.740200     -2.9000000E-03
 H    4.241100       1.783400      9.8999999E-03
 H    5.516900      0.6495000     -2.0999999E-03
 H   -4.315700       1.587400     -1.6000000E-03
 H   -6.362800      0.2896000     -1.2000001E-03
 H   -5.405600      -1.297500      3.0000001E-04


%chk=000086944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086944

0 1
O 4.170470 -1.478449 -0.009152
O -2.884033 -1.419754 0.004218
N -1.936644 0.737063 -0.002572
N 4.637471 0.783350 0.010619
C -0.547654 0.452907 -0.002944
C 2.274264 0.039176 -0.003549
C 0.346876 1.559656 -0.006697
C -0.021369 -0.868907 -0.000071
C 1.736754 1.353745 -0.006851
C 1.371993 -1.054919 -0.000560
C 3.745928 -0.280624 -0.003786
C -3.017980 -0.159316 0.000739
C -4.350504 0.524481 0.000451
C -5.502530 -0.193123 0.003652
H -0.050178 2.582915 -0.009823
H -0.707936 -1.716624 0.002427
H 2.383785 2.238526 -0.011435
H 1.799315 -2.062851 0.001102
H -2.180453 1.730706 -0.004953
H 4.352007 1.758666 0.023581
H 5.631536 0.559571 0.012959
H -4.375974 1.623546 -0.002419
H -6.485424 0.288358 0.003486
H -5.457722 -1.288499 0.006476


