%chk=000076014.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076014

0 1
 O   -5.204300      0.3777000      -1.102200    
 O    3.263300     -0.7711000     -0.4866000    
 N   -2.881600      0.3834000      0.5431000    
 C    1.253900      -2.710800      4.5000002E-02
 C    2.886900       2.032400     -0.2033000    
 C    1.025100      -1.243700      0.2032000    
 C    1.810500       1.037900      8.3899997E-02
 C  -0.4421000      0.5706000      0.7802000    
 C    2.042100     -0.3289000     -7.0200004E-02
 C   -1.789700       1.059000       1.241000    
 C  -0.2234000     -0.7917000      0.6305000    
 C   0.5621000       1.489900      0.5113000    
 C   -2.797700      0.6157000     -0.9056000    
 C   -4.184300      0.8357000       1.050800    
 C  -6.5399997E-02  -3.449000     -0.3384000    
 C    1.782200      -3.345300       1.368200    
 C    2.291900      -3.112100      -1.054100    
 C    2.388200       3.489500      4.2500000E-02
 C    3.359600       1.939400      -1.686500    
 C    4.183400       1.883300      0.6586000    
 C   -3.953700     -8.7899998E-02  -1.610900    
 C   -5.307200      0.1260000      0.2997000    
 H   -1.855700      0.8616000       2.319000    
 H   -1.869400       2.146800       1.111900    
 H   -1.021100      -1.475800      0.8948000    
 H   0.3169000       2.534700      0.6543000    
 H   -1.871100      0.2303000      -1.342100    
 H   -2.846900       1.691800      -1.119200    
 H   -4.288600       1.920800      0.9207000    
 H   -4.274600      0.6113000       2.119700    
 H   0.1278000      -4.499900     -0.5872000    
 H  -0.7890000      -3.477100      0.4834000    
 H  -0.5423000      -2.990300      -1.212700    
 H    1.072100      -3.188300       2.188600    
 H    1.934100      -4.425100       1.259100    
 H    2.735200      -2.898000       1.672100    
 H    2.183600      -4.172200      -1.318300    
 H    2.140800      -2.543900      -1.979200    
 H    3.333100      -3.024000     -0.7303000    
 H    3.185600       4.209000     -0.1853000    
 H    1.550300       3.757600     -0.6121000    
 H    2.112100       3.663800       1.089400    
 H    2.505000       2.005300      -2.370500    
 H    4.039600       2.764200      -1.931800    
 H    3.895700       1.014200      -1.914900    
 H    4.893400       2.693300      0.4545000    
 H    3.937000       1.913000       1.726400    
 H    4.708700      0.9426000      0.4715000    
 H   -3.894100      -1.177300      -1.497400    
 H   -3.928000      0.1353000      -2.682400    
 H   -6.277800      0.5051000      0.6354000    
 H   -5.293500     -0.9559000      0.4795000    
 H    3.659400      -1.237300      0.2708000    


%chk=000076014-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076014

0 1
O -5.400696 0.222641 -1.195239
O 3.414309 -0.724826 -0.282741
N -2.957886 0.469906 0.358767
C 1.269049 -2.788149 0.097643
C 3.052064 2.120129 -0.091803
C 1.041361 -1.253858 0.229410
C 1.901097 1.106182 0.141954
C -0.475532 0.646421 0.677306
C 2.097763 -0.304824 0.035822
C -1.855504 1.158952 1.075331
C -0.235749 -0.738206 0.552453
C 0.593205 1.542722 0.465010
C -2.982967 0.788028 -1.092320
C -4.286209 0.733219 0.966747
C -0.039853 -3.588145 0.344109
C 2.292348 -3.292951 1.168546
C 1.735764 -3.161158 -1.349253
C 2.574601 3.588971 0.072262
C 3.609523 1.971830 -1.541097
C 4.193504 1.883131 0.944746
C -4.076559 -0.035126 -1.789053
C -5.364739 -0.090447 0.243219
H -2.021324 0.982616 2.158173
H -1.891842 2.268597 0.925661
H -1.086203 -1.409137 0.697102
H 0.396130 2.615542 0.551856
H -1.996960 0.545169 -1.528639
H -3.177953 1.877614 -1.262565
H -4.559603 1.817678 0.909141
H -4.257443 0.445319 2.035526
H 0.167693 -4.668401 0.233432
H -0.435466 -3.424429 1.362447
H -0.827469 -3.319619 -0.382611
H 1.901726 -3.095565 2.182987
H 2.443683 -4.383270 1.061354
H 3.288238 -2.814148 1.117973
H 1.891256 -4.253555 -1.425547
H 0.959626 -2.870825 -2.080051
H 2.672295 -2.670804 -1.674598
H 3.431416 4.264379 -0.106006
H 1.785201 3.853099 -0.656014
H 2.196888 3.792187 1.091708
H 2.817519 2.177754 -2.285421
H 4.429132 2.697974 -1.702433
H 4.000608 0.957826 -1.715611
H 5.009469 2.611633 0.775387
H 3.817771 2.022723 1.975732
H 4.606847 0.866823 0.856119
H -3.834734 -1.117179 -1.706637
H -4.172141 0.244305 -2.851297
H -6.371855 0.150064 0.622564
H -5.160054 -1.174090 0.384709
H 3.456751 -1.709119 -0.328357


