%chk=000060018.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060018

0 1
 O   -4.866300       1.357700      1.2000001E-03
 O   -2.879300       2.290900      6.0000003E-04
 O    5.259500     -0.7793000     -1.4000000E-03
 O    4.581100       1.308500     -5.0000002E-04
 N   -3.613600       1.272500      3.0000001E-04
 N    4.344900      7.7600002E-02 -9.9999997E-05
 C   0.6470000      8.9999996E-03  3.0000001E-04
 C  -0.5316000      0.7421000     -3.9999999E-04
 C   0.3693000      -1.350900      3.0000001E-04
 C   -1.641800     -0.2005000     -3.9999999E-04
 C   -1.078500      -1.509200       0.000000    
 C    1.926600      0.5597000      6.0000003E-04
 C   -3.010600     -1.1400000E-02 -1.0000000E-03
 C    1.417600      -2.252100      6.0000003E-04
 C  -0.4656000       2.122900     -8.9999998E-04
 C    2.991500     -0.3621000      1.2000001E-03
 C   -1.882100      -2.633300     -9.9999997E-05
 C    1.989100       1.966900      3.9999999E-04
 C    2.731300      -1.749700      1.1000000E-03
 C   0.8023000       2.731500     -5.0000002E-04
 C   -3.823800      -1.148500     -1.0000000E-03
 C   -3.266700      -2.442200     -5.0000002E-04
 H    1.244100      -3.323200      6.0000003E-04
 H   -1.167700       2.924900     -3.4000000E-03
 H   -1.464500      -3.634000      3.0000001E-04
 H    2.892800       2.558700      6.9999998E-04
 H    3.538700      -2.479300      1.1000000E-03
 H   0.8778000       3.817400     -1.1000000E-03
 H   -4.909500      -1.076600     -1.1000000E-03
 H   -3.926600      -3.306300     -5.0000002E-04


%chk=000060018-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060018

0 1
O -5.163092 1.153031 -0.000480
O -3.232254 2.342601 -0.001677
O 5.345313 -0.992748 0.000218
O 4.815982 1.216819 0.000817
N -3.872836 1.222969 -0.000315
N 4.479506 -0.031710 0.000036
C 0.668059 0.081734 -0.000103
C -0.539446 0.869339 -0.000272
C 0.366273 -1.313824 0.000056
C -1.678182 -0.103315 -0.000187
C -1.100183 -1.435605 0.000007
C 1.990608 0.614889 -0.000098
C -3.099097 -0.042965 -0.000206
C 1.408049 -2.247983 0.000212
C -0.396834 2.265091 -0.000460
C 3.036417 -0.385605 0.000042
C -1.877189 -2.604273 0.000107
C 2.092006 2.051668 -0.000288
C 2.745654 -1.764307 0.000202
C 0.922675 2.824382 -0.000461
C -3.889092 -1.226163 -0.000109
C -3.288164 -2.495284 0.000039
H 1.225773 -3.326973 0.000350
H -1.263028 2.923160 -0.000640
H -1.398905 -3.589138 0.000246
H 3.072633 2.526712 -0.000292
H 3.587972 -2.461014 0.000301
H 1.016678 3.915609 -0.000621
H -4.975775 -1.113018 -0.000124
H -3.914123 -3.392379 0.000101


