%chk=000070045.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070045

0 1
 O   0.1349000       3.192100      1.5400000E-02
 O   -1.828100       2.209500      1.0400000E-02
 O    4.085800      -1.581500     -1.8999999E-02
 O    4.175000      0.6119000     -2.9000000E-03
 N   -2.096300     -0.2635000     -5.2999998E-03
 N  -0.5759000       2.159900      9.8999999E-03
 N    3.522800     -0.4601000     -1.0200000E-02
 C  -0.6835000     -0.2921000     -6.3999998E-03
 C   -2.826700     -0.2579000       1.245000    
 C   -2.827700     -0.2253000      -1.254600    
 C   6.1200000E-02  0.8873000      2.0999999E-03
 C  -3.4400001E-02  -1.526800     -1.5799999E-02
 C   -2.924200      -1.666300       1.799100    
 C   -3.101100      -1.634800      -1.742900    
 C    1.454900      0.8321000      1.0000000E-03
 C    1.359300      -1.581900     -1.7100001E-02
 C    2.104000     -0.4025000     -8.7000001E-03
 H   -2.337800      0.3897000       1.982900    
 H   -3.837600      0.1423000       1.104300    
 H   -3.777700      0.3091000      -1.136500    
 H   -2.262200      0.3188000      -2.021200    
 H  -0.5973000      -2.456300     -2.2600001E-02
 H   -3.394900      -2.359100       1.098100    
 H   -1.941300      -2.067400       2.063700    
 H   -3.527600      -1.662400       2.713300    
 H   -2.180400      -2.208200      -1.883000    
 H   -3.747100      -2.185700      -1.054700    
 H   -3.615000      -1.597600      -2.709400    
 H    2.039600       1.749000      7.3000002E-03
 H    1.830700      -2.561400     -2.4700001E-02


%chk=000070045-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070045

0 1
O 0.127700 2.521217 -2.061926
O -1.446032 2.504666 -0.406881
O 4.315074 -1.176998 0.926803
O 4.327224 0.481431 -0.647804
N -1.986629 -0.397101 0.153306
N -0.436388 1.979100 -1.031927
N 3.714508 -0.319070 0.163221
C -0.617368 -0.228296 0.268401
C -2.748242 -1.069237 1.243959
C -2.763087 0.152549 -0.990355
C 0.155749 0.747845 -0.473397
C 0.151080 -1.105915 1.116735
C -2.913158 -2.601422 1.106581
C -3.859517 -0.789182 -1.522715
C 1.561666 0.688837 -0.546253
C 1.543606 -1.128639 1.097979
C 2.248959 -0.259737 0.223772
H -2.259261 -0.825944 2.204204
H -3.745440 -0.594662 1.279482
H -3.195939 1.132700 -0.709478
H -2.052980 0.346483 -1.812871
H -0.368349 -1.821614 1.756355
H -3.496813 -2.869647 0.212143
H -1.941071 -3.118896 1.040346
H -3.447913 -2.991146 1.992319
H -3.441325 -1.750106 -1.869226
H -4.651017 -0.991779 -0.780804
H -4.341110 -0.295615 -2.385830
H 2.108903 1.416649 -1.151158
H 2.108573 -1.825569 1.722519


