%chk=000006021.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006021

0 1
 O    2.013400     -0.5158000     -0.9536000    
 O    1.220100       2.278800       1.163400    
 O    3.414500       2.142100     -0.4338000    
 O    3.801700      -2.596300     -0.3740000    
 O   -4.548800      -1.380000      0.4164000    
 N  -0.2008000     -0.2507000     -0.1427000    
 N   -1.844300       1.500700     -0.5408000    
 N   -1.641600      -1.887500      0.3962000    
 N   -4.130100      0.8115000     -0.2202000    
 C    1.728800      0.9999000      0.8438000    
 C    1.070500      0.4221000     -0.3998000    
 C    3.186500       1.027400      0.4284000    
 C    3.317500     -0.2573000     -0.3837000    
 C    3.717200      -1.456900      0.4639000    
 C   -1.449700      0.2656000     -0.2169000    
 C  -0.3691000      -1.564900      0.2348000    
 C   -2.319900     -0.7358000      0.1120000    
 C   -3.753500     -0.4952000      0.1245000    
 C   -3.212400       1.692300     -0.5180000    
 H   0.8766000       1.186500      -1.161900    
 H    1.591500      0.3413000       1.709300    
 H    3.877400       1.109500       1.272200    
 H    4.010700     -0.1488000      -1.225600    
 H    2.981700      -1.672800       1.245100    
 H    4.693200      -1.300500      0.9326000    
 H    1.390700       2.867500      0.4086000    
 H   0.4658000      -2.236600      0.3813000    
 H    4.343800       2.103400     -0.7179000    
 H   -1.210300       2.254700     -0.7836000    
 H    2.929900      -2.722200     -0.7864000    
 H   -3.499600       2.720400     -0.7894000    


%chk=000006021-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006021

0 1
O 2.134027 -0.846222 -0.839713
O 0.978303 2.497107 0.189682
O 3.364800 2.126432 -0.760185
O 3.916096 -2.632025 0.511466
O -4.755506 -1.285461 0.189323
N -0.197894 -0.468081 -0.564314
N -1.630912 1.474923 0.134129
N -1.835954 -2.069651 -0.599881
N -3.962531 0.920539 0.485165
C 1.511873 1.154763 0.352726
C 1.096118 0.185736 -0.797198
C 3.058847 1.119220 0.271090
C 3.376384 -0.324197 -0.168244
C 3.704199 -1.274427 0.996559
C -1.390504 0.152938 -0.195644
C -0.540021 -1.824762 -0.816325
C -2.395744 -0.835159 -0.208552
C -3.781662 -0.491482 0.153513
C -2.962115 1.773621 0.465129
H 1.079279 0.734200 -1.761900
H 1.155158 0.769772 1.322000
H 3.538693 1.385634 1.231861
H 4.183765 -0.364280 -0.921607
H 2.896400 -1.236855 1.759413
H 4.659077 -0.984359 1.469109
H 1.626514 2.990945 -0.388264
H 0.206981 -2.542330 -1.140357
H 4.331966 2.318884 -0.804387
H -0.869051 2.175824 0.160255
H 3.096038 -2.923592 0.035592
H -3.141222 2.824746 0.723758


