%chk=000154198.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154198

0 1
 O   0.1964000       2.454600       2.367100    
 O   -1.106700       1.496000      -2.317200    
 O    4.042000     -0.6336000      -1.317700    
 N   -1.854900       1.028300     -0.3967000    
 N   -2.118100       1.487000      -1.605300    
 N    2.605000      -2.319800      0.3776000    
 N    2.845900      -3.369100      0.5251000    
 C   -1.337100       2.052700      0.5254000    
 C  -0.2935000       1.453600       1.476000    
 C   -3.003400      0.3604000      0.2042000    
 C   -3.077900      -1.091700     -0.2646000    
 C   0.8827000      0.8796000      0.7170000    
 C   -4.264200      -1.817500      0.3711000    
 C    1.211200     -0.4544000      0.8865000    
 C    1.607200       1.702300     -0.1281000    
 C   -4.366200      -3.253400     -0.1177000    
 C    2.298000     -0.9819000      0.1893000    
 C    2.694000       1.174500     -0.8253000    
 C    3.039400     -0.1676000     -0.6666000    
 H  -0.8828000       2.894600     -1.7899999E-02
 H   -2.145300       2.529300       1.099900    
 H  -0.7535000      0.6793000       2.101500    
 H   -3.944700      0.8898000     -1.9000000E-03
 H   -2.912400      0.3301000       1.298600    
 H   -2.148800      -1.615500     -4.9000001E-03
 H   -3.177200      -1.134100      -1.356500    
 H   -5.195300      -1.290800      0.1313000    
 H   -4.161600      -1.815000       1.462500    
 H   0.6345000      -1.091000       1.552300    
 H    1.364700       2.752900     -0.2536000    
 H   -5.219500      -3.753700      0.3509000    
 H   -4.505200      -3.289800      -1.202900    
 H   -3.462100      -3.817900      0.1324000    
 H  -0.5675000       2.818400       2.846300    
 H    3.257000       1.833800      -1.484400    


%chk=000154198-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154198

0 1
O 0.192172 2.050216 2.503714
O -0.675299 2.429091 -1.872837
O 4.087377 -0.528196 -1.721912
N -2.062145 1.312120 -0.477803
N -1.654218 1.604204 -1.783407
N 2.390398 -2.385543 -0.606014
N 2.891814 -3.381778 -0.986327
C -1.461748 1.981043 0.688484
C -0.382152 1.160517 1.469973
C -3.257355 0.451609 -0.394795
C -3.028619 -0.922690 0.274155
C 0.778965 0.684427 0.622672
C -4.305975 -1.792740 0.220490
C 1.006481 -0.667952 0.426225
C 1.679290 1.644676 0.018470
C -4.115438 -3.167985 0.894954
C 2.119592 -1.093863 -0.375624
C 2.767827 1.263256 -0.744124
C 3.097597 -0.132489 -1.022795
H -0.981671 2.906697 0.317146
H -2.278502 2.252813 1.386555
H -0.868272 0.286353 1.950777
H -3.590442 0.307511 -1.438416
H -4.059571 0.996931 0.144262
H -2.728223 -0.792658 1.333561
H -2.197718 -1.443368 -0.240817
H -4.605451 -1.936829 -0.836912
H -5.140980 -1.251990 0.711177
H 0.359148 -1.425849 0.881205
H 1.491530 2.708999 0.191212
H -5.039954 -3.770672 0.843842
H -3.310418 -3.744260 0.401935
H -3.845143 -3.055829 1.961946
H -0.529955 2.370300 3.104527
H 3.437156 2.004330 -1.191795


