%chk=000068857.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068857

0 1
 O   -3.716400     -0.5478000      -1.398900    
 O    1.491600      -1.561100       1.069900    
 O    3.606200     -0.9257000       2.763000    
 N    3.644500      0.7117000     -0.5578000    
 C   -2.440700      0.4865000      0.4465000    
 C   -3.447700      0.2842000       1.595100    
 C   -2.449900       1.934600     -7.6300003E-02
 C   -1.000900      9.1399997E-02  0.9159000    
 C   -4.835800      0.8516000       1.300400    
 C   -3.850500       2.485200     -0.3432000    
 C   -2.726600     -0.5050000     -0.6895000    
 C   -4.768400       2.308000      0.8593000    
 C  -0.6480000      -1.112200      0.1030000    
 C   -1.626000      -1.446200     -0.8204000    
 C   0.5126000      -1.866000      0.1791000    
 C   -1.506300      -2.515700      -1.689600    
 C   0.6629000      -2.955400     -0.6853000    
 C  -0.3405000      -3.277500      -1.613800    
 C    2.832900      -1.883100      0.7003000    
 C    3.778200     -0.8712000       1.344000    
 C    3.392200       2.086900     -0.9663000    
 C    3.528100      0.5679000      0.8871000    
 C    3.517500       2.174400      -2.491000    
 C    1.974000       2.472500     -0.5323000    
 C    4.417100       3.011900     -0.2995000    
 H   -3.066300      0.7766000       2.499600    
 H   -3.546100     -0.7818000       1.836000    
 H   -1.858900       2.011900     -0.9978000    
 H   -1.964800       2.586200      0.6629000    
 H  -0.9736000     -0.1556000       1.983100    
 H  -0.2787000      0.8917000      0.7301000    
 H   -5.458800      0.7710000       2.198800    
 H   -5.329100      0.2541000      0.5254000    
 H   -4.288700       1.989500      -1.216800    
 H   -3.779500       3.550000     -0.5943000    
 H   -5.774300       2.664700      0.6108000    
 H   -4.407000       2.926200       1.690200    
 H   -2.283800      -2.762300      -2.403500    
 H    1.535500      -3.602000     -0.6515000    
 H  -0.2092000      -4.131300      -2.273000    
 H    3.052900      -2.886700       1.083300    
 H    2.985100      -1.872300     -0.3858000    
 H    4.816000      -1.151000       1.126300    
 H    4.254000       1.184800       1.427800    
 H    2.540200      0.8483000       1.265300    
 H    4.574500      0.4184000     -0.8565000    
 H    2.802500       1.508800      -2.988900    
 H    3.322500       3.192600      -2.846600    
 H    4.523200       1.895100      -2.826800    
 H    1.866700       2.639800      0.5440000    
 H    1.239700       1.724100     -0.8511000    
 H    1.681200       3.417800      -1.006900    
 H    5.442300       2.646500     -0.4330000    
 H    4.375500       4.010100     -0.7534000    
 H    4.239100       3.163700      0.7702000    
 H    3.800200      -1.835400       3.046500    


%chk=000068857-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068857

0 1
O -4.419248 -0.811107 -0.850400
O 1.371509 -1.018857 0.576198
O 3.109437 -0.940848 2.746455
N 4.551609 0.755422 -0.302055
C -2.869460 0.412485 0.714713
C -3.702357 0.213581 2.022690
C -3.100029 1.865544 0.176758
C -1.345079 0.149633 0.968850
C -5.193856 0.593191 1.875962
C -4.592494 2.237194 0.024391
C -3.262949 -0.630711 -0.372856
C -5.353383 2.041557 1.357190
C -0.945571 -0.937497 -0.009050
C -2.043888 -1.385855 -0.771915
C 0.328294 -1.515776 -0.218672
C -1.923527 -2.403274 -1.748845
C 0.473223 -2.533402 -1.194408
C -0.649670 -2.968943 -1.948977
C 2.729095 -1.584008 0.390122
C 3.625008 -0.823811 1.374724
C 4.384134 1.982489 -1.151207
C 3.805933 0.661916 0.972320
C 5.396449 1.843488 -2.314226
C 2.946273 2.014248 -1.727550
C 4.670791 3.294824 -0.362150
H -3.241338 0.854441 2.804449
H -3.603141 -0.834506 2.369527
H -2.565569 1.995173 -0.785681
H -2.627268 2.560613 0.902829
H -1.162172 -0.174487 2.012139
H -0.740173 1.064288 0.818574
H -5.696771 0.478185 2.856232
H -5.682026 -0.102121 1.168790
H -5.054450 1.602848 -0.754576
H -4.673244 3.288873 -0.314095
H -6.425754 2.279580 1.220510
H -4.958633 2.751719 2.115094
H -2.800280 -2.724800 -2.318743
H 1.448270 -2.994262 -1.378013
H -0.508160 -3.758241 -2.695409
H 2.707819 -2.665261 0.626834
H 3.080600 -1.406723 -0.643899
H 4.613178 -1.319627 1.401852
H 4.291966 1.180746 1.827789
H 2.805739 1.110687 0.839855
H 5.553254 0.560236 -0.157691
H 5.202861 0.916233 -2.882197
H 5.321757 2.702381 -3.004600
H 6.436232 1.806979 -1.933376
H 2.184395 2.120276 -0.933938
H 2.738153 1.080982 -2.279886
H 2.828766 2.869418 -2.417570
H 5.706476 3.300097 0.028147
H 4.544347 4.182461 -1.009710
H 3.980996 3.402038 0.494982
H 2.136326 -0.746307 2.707823


