%chk=000013685.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013685

0 1
 O   -1.511900      0.6453000       0.000000    
 O   -4.865300     -0.3381000     -1.2000001E-03
 O   -3.922300       1.648900     -3.9999999E-04
 N   -3.827600      0.3867000     -6.9999998E-04
 N    1.988800     -0.1072000     -1.9999999E-04
 N    3.068400      0.7710000      9.9999997E-05
 N    5.401600      0.8400000      1.5000000E-03
 N    4.406800      -1.217600     -2.6000000E-03
 C  -0.4150000     -0.1337000      6.0000003E-04
 C  -0.7147000      -1.456300      1.3000000E-03
 C   -2.566300     -0.2118000      5.0000002E-04
 C   -2.128700      -1.515900      1.3000000E-03
 C   0.8701000      0.5432000      3.0000001E-04
 C    4.216200      0.1457000     -3.9999999E-04
 H  -2.4599999E-02  -2.287900      1.7000000E-03
 H   -2.746000      -2.403300      1.6000000E-03
 H   0.8461000       1.648800      3.9999999E-04
 H    6.295800      0.3618000      1.6000000E-03
 H    5.415000       1.854200      3.5999999E-03
 H    5.336600      -1.622300     -2.2000000E-03
 H    3.619200      -1.856800     -3.7000000E-03


%chk=000013685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013685

0 1
O -1.514193 0.711630 0.000474
O -4.866531 -0.570088 -0.000042
O -4.089358 1.601059 0.000785
N -3.910148 0.317596 0.000344
N 2.056495 0.003964 0.000239
N 3.178400 0.834546 0.000540
N 5.500545 0.802794 0.000515
N 4.336412 -1.273287 -0.000449
C -0.337023 -0.072769 0.000245
C -0.690713 -1.437637 -0.000183
C -2.580422 -0.196904 0.000180
C -2.113825 -1.512812 -0.000227
C 0.900048 0.656366 0.000493
C 4.322015 0.096390 0.000200
H 0.015273 -2.263844 -0.000423
H -2.742458 -2.399344 -0.000510
H 0.853104 1.755737 0.000893
H 6.414446 0.360687 0.000135
H 5.424457 1.817846 0.001002
H 5.180060 -1.837646 -0.000491
H 3.405614 -1.699585 -0.000620


