%chk=000115211.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115211

0 1
 O    4.418500     -0.9305000       1.548800    
 O    4.740600      0.5042000      -1.753000    
 O   -2.076100       3.503400      0.1602000    
 O   -3.948900       2.363800      4.7600001E-02
 N   -2.700200       2.421800      9.0599999E-02
 C    2.514200     -0.8581000      8.8200003E-02
 C    4.024200     -0.7791000      0.1829000    
 C    1.712100      0.3011000      0.1363000    
 C   0.2833000      0.1930000      8.4500000E-02
 C  -0.3320000      -1.091200     -4.8000002E-03
 C    4.596000      0.5472000     -0.3360000    
 C   -1.770800      -1.213700     -5.4900002E-02
 C    1.908200      -2.107800      3.1999999E-03
 C    2.411600       1.600000      0.2456000    
 C   0.5208000      -2.216600     -4.2700000E-02
 C    3.723400       1.716100     -1.9000000E-03
 C   -2.567700     -4.4100001E-02 -2.0600000E-02
 C  -0.5692000       1.316400      0.1081000    
 C   -1.956600       1.202800      5.8499999E-02
 C   -2.472800      -2.445500     -0.1385000    
 C   -3.970900     -0.1215000     -6.7699999E-02
 C   -3.868700      -2.512900     -0.1849000    
 C   -4.618800      -1.349000     -0.1494000    
 H    4.469600      -1.605300     -0.3854000    
 H    5.591500      0.7133000      9.1200002E-02
 H    2.510400      -3.012600     -2.1400001E-02
 H    1.862400       2.493900      0.5107000    
 H   0.1231000      -3.225900     -0.1086000    
 H    4.188400       2.696500      5.0999999E-02
 H  -0.1227000       2.304800      0.1579000    
 H   -1.943800      -3.394400     -0.1694000    
 H   -4.727300      0.6402000     -4.8500001E-02
 H    3.906900      -1.660400       1.937200    
 H    3.878800      0.2753000      -2.141200    
 H   -4.362500      -3.478200     -0.2484000    
 H   -5.703200      -1.400400     -0.1843000    


%chk=000115211-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115211

0 1
O 4.378362 -0.887595 1.642966
O 5.003377 0.461420 -1.707862
O -1.932007 3.634181 0.179927
O -3.950953 2.613036 0.089921
N -2.659714 2.564721 0.115563
C 2.493900 -0.883537 0.049413
C 4.002813 -0.804655 0.204732
C 1.701378 0.290435 0.097935
C 0.258846 0.168562 0.058417
C -0.369471 -1.128727 -0.031921
C 4.626141 0.522416 -0.272151
C -1.834046 -1.225067 -0.054098
C 1.866840 -2.150792 -0.074353
C 2.386192 1.593115 0.149352
C 0.472075 -2.277127 -0.109977
C 3.737680 1.715615 -0.014876
C -2.664102 -0.036087 -0.003824
C -0.580477 1.327476 0.099722
C -1.965204 1.242039 0.068682
C -2.478945 -2.498595 -0.122460
C -4.088502 -0.187726 -0.026389
C -3.871938 -2.621483 -0.143716
C -4.679451 -1.455058 -0.095480
H 4.488640 -1.631620 -0.352330
H 5.591251 0.625814 0.250407
H 2.493340 -3.049071 -0.144250
H 1.793991 2.501682 0.291677
H 0.041653 -3.276375 -0.205388
H 4.210738 2.703393 -0.016686
H -0.153685 2.329889 0.154418
H -1.877958 -3.410615 -0.155931
H -4.713095 0.702540 0.011383
H 3.854567 -1.612888 2.069798
H 4.195217 0.640580 -2.255165
H -4.334613 -3.612588 -0.195754
H -5.771040 -1.540708 -0.110805


