%chk=000043347.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043347

0 1
 N   0.8926000      0.1116000      0.4096000    
 N   -1.178700      -1.084800      0.2596000    
 N   0.9124000      -2.219800      0.1513000    
 N   -2.727500       2.167900     -0.5407000    
 N  -0.3088000      -4.113200     -0.9389000    
 C    2.984900       1.243300     -0.3016000    
 C    2.359000     -2.2399999E-02  0.3601000    
 C    2.423700       1.509200      -1.711000    
 C    2.702000       2.480100      0.5786000    
 C    4.515200       1.085200     -0.4097000    
 C    2.847000     -0.3425000       1.772500    
 C   0.2025000     -0.9726000      0.3060000    
 C   -2.160300     -7.6899998E-02  0.1302000    
 C   -3.469500     -0.3084000      0.5229000    
 C   -1.837600       1.161300     -0.3902000    
 C   -4.413800      0.7027000      0.3836000    
 C   0.2527000      -3.232500     -0.4335000    
 C   -3.995700       1.911700     -0.1489000    
 H    2.681000     -0.8215000     -0.3177000    
 H    2.912600       2.371500      -2.178700    
 H    2.581600      0.6431000      -2.363200    
 H    1.349900       1.718600      -1.686600    
 H    3.093700       3.388900      0.1058000    
 H    1.628200       2.633400      0.7304000    
 H    3.178300       2.406700       1.561400    
 H    4.779400      0.1821000     -0.9711000    
 H    4.995500       1.026800      0.5721000    
 H    4.962500       1.939500     -0.9312000    
 H    3.929800     -0.4919000       1.800900    
 H    2.591900      0.4540000       2.478800    
 H    2.391700      -1.254900       2.170700    
 H   -1.582800      -1.996200      0.4581000    
 H    1.890000      -2.320600      0.3891000    
 H   -3.769200      -1.266600      0.9382000    
 H  -0.8480000       1.413400     -0.7488000    
 H   -5.444400      0.5495000      0.6825000    
 H   -4.693500       2.732400     -0.2781000    


%chk=000043347-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043347

0 1
N 0.948824 0.001654 0.251338
N -1.162892 -1.093719 0.068867
N 0.797278 -2.408973 0.000210
N -2.612770 2.354247 0.466462
N -0.586966 -4.532375 -0.262741
C 3.008262 1.260279 -0.370773
C 2.426572 -0.019568 0.340581
C 2.496580 1.273865 -1.835976
C 2.551565 2.556161 0.345226
C 4.558147 1.184434 -0.384137
C 2.830197 -0.171036 1.829914
C 0.232221 -1.070165 0.119651
C -2.073462 -0.014380 0.164712
C -3.459276 -0.313120 0.046043
C -1.699083 1.345363 0.375122
C -4.399853 0.729225 0.140128
C 0.087279 -3.543772 -0.142912
C -3.937213 2.049562 0.350946
H 2.872099 -0.879801 -0.228584
H 2.908199 2.143703 -2.380364
H 2.806657 0.358958 -2.378854
H 1.395050 1.335767 -1.865960
H 2.884076 3.441876 -0.227102
H 1.451727 2.591951 0.426938
H 2.977662 2.637049 1.361995
H 4.913436 0.242208 -0.845792
H 4.988701 1.256990 0.630860
H 4.969413 2.021619 -0.977622
H 3.926269 -0.153444 1.954572
H 2.392189 0.644080 2.429887
H 2.454879 -1.125074 2.244524
H -1.592759 -2.014384 -0.063168
H 1.818107 -2.457052 -0.004269
H -3.790950 -1.346386 -0.118182
H -0.645190 1.608330 0.468603
H -5.471307 0.524218 0.050881
H -4.635370 2.889813 0.431477


