%chk=000012091.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012091

0 1
 O   -3.471500      -1.110200      9.4999997E-03
 O    3.426800       1.118300      1.6000000E-03
 O    3.449500      -1.076800     -1.0000000E-03
 N    2.829800      1.4500000E-02  3.0000001E-04
 N   -3.493300       1.182900     -3.8000001E-03
 C   -1.379400     -2.8500000E-02 -1.6000000E-03
 C    1.410200     -9.9999997E-05  7.9999998E-04
 C  -0.6944000       1.186500      1.6000000E-03
 C  -0.6697000      -1.229400     -3.5000001E-03
 C   0.7005000       1.200600      2.6000000E-03
 C   0.7251000      -1.215100     -2.2000000E-03
 C   -2.833600     -4.2700000E-02 -4.3000001E-03
 H   -1.179400       2.155200      3.5999999E-03
 H   -1.181100      -2.188400     -6.3999998E-03
 H    1.201700       2.165300      4.8000002E-03
 H    1.245000      -2.169700     -4.1999999E-03
 H   -3.054900       2.094600     -1.0600000E-02
 H   -4.508400       1.199900      1.4000000E-03


%chk=000012091-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012091

0 1
O -3.491967 -1.163044 0.011994
O 3.526191 1.116205 0.002052
O 3.499524 -1.165194 -0.003861
N 2.908392 -0.018032 -0.000654
N -3.605627 1.146040 -0.006382
C -1.384637 0.040382 0.000135
C 1.422821 -0.000821 -0.000294
C -0.649619 1.255709 0.003989
C -0.684424 -1.193874 -0.003067
C 0.758028 1.243824 0.003695
C 0.721339 -1.226049 -0.003500
C -2.897230 -0.042064 0.000108
H -1.151821 2.228914 0.008822
H -1.276063 -2.114377 -0.005056
H 1.344560 2.165970 0.006799
H 1.278459 -2.166236 -0.006175
H -3.171704 2.065406 -0.016816
H -4.623320 1.084141 -0.003189


