%chk=000131584.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131584

0 1
 O   -5.371200      0.8988000      -1.125900    
 O    2.286500      -2.725500     -5.0200000E-02
 O    3.118600       1.827600      0.7397000    
 N  -0.6016000      -1.973400     -5.1800001E-02
 N   0.9077000       1.133800      0.5288000    
 N   -1.316700      0.1144000      0.2637000    
 N    2.732200     -0.4487000      0.3456000    
 C   -3.104700      -1.652500     -0.1046000    
 C   -3.949800      -1.405300       1.151800    
 C   -3.913600      -1.021800      -1.243900    
 C   -4.608800     -4.4399999E-02  0.9578000    
 C   -1.680000      -1.131900      4.1499998E-02
 C   -4.713200      4.7600001E-02 -0.5410000    
 C   5.0500002E-02  6.3199997E-02  0.3139000    
 C   0.5163000      -1.209000      0.1228000    
 C    1.895700      -1.574600      0.1223000    
 C   0.3636000       2.471500      0.7276000    
 C    2.307700      0.9135000      0.5525000    
 C    4.169800     -0.6962000      0.3678000    
 C   0.2266000       3.192200     -0.6111000    
 C    4.753900     -0.5524000      -1.035200    
 C  -0.3196000       4.599900     -0.4289000    
 C    6.249900     -0.8268000      -1.043100    
 H   -3.034900      -2.734600     -0.2797000    
 H   -3.373300      -1.448200       2.081700    
 H   -4.732500      -2.172600       1.214400    
 H   -4.616400      -1.743900      -1.671400    
 H   -3.285200     -0.5867000      -2.025000    
 H   -3.970500      0.7658000       1.320900    
 H   -5.594000     -9.9999997E-05   1.426900    
 H  -0.6283000      -2.971000     -0.2179000    
 H  -0.6012000       2.405600       1.244100    
 H    1.040300       3.034500       1.381200    
 H    4.657400      6.3999998E-03   1.053100    
 H    4.361600      -1.705200      0.7508000    
 H    1.200400       3.244800      -1.112700    
 H  -0.4404000       2.630400      -1.275900    
 H    4.257400      -1.245900      -1.724300    
 H    4.570000      0.4581000      -1.419200    
 H   -1.309600       4.578500      3.7599999E-02
 H   0.3451000       5.199900      0.2007000    
 H  -0.4115000       5.099100      -1.398600    
 H    6.780600     -0.1254000     -0.3913000    
 H    6.463700      -1.844400     -0.7007000    
 H    6.649700     -0.7183000      -2.056200    


%chk=000131584-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131584

0 1
O -5.319218 1.226395 -0.743458
O 2.359373 -2.806422 0.000881
O 3.069435 1.818170 0.689069
N -0.657903 -2.072485 -0.085099
N 0.856557 1.087355 0.477065
N -1.388047 0.063560 0.164844
N 2.699512 -0.483418 0.367366
C -3.179052 -1.712298 -0.197693
C -3.984473 -1.588615 1.151493
C -3.991570 -0.822516 -1.181250
C -4.493732 -0.130121 1.171072
C -1.762256 -1.232233 -0.045933
C -4.688499 0.237799 -0.306083
C -0.001231 0.020537 0.261028
C 0.482564 -1.286489 0.111219
C 1.875890 -1.640028 0.144193
C 0.340965 2.474328 0.603337
C 2.255469 0.865767 0.518280
C 4.173154 -0.699147 0.400712
C 0.228832 3.191583 -0.760256
C 4.824219 -0.506119 -0.986704
C -0.322768 4.622590 -0.591024
C 6.346970 -0.748215 -0.924362
H -3.154506 -2.765475 -0.532851
H -3.366572 -1.844640 2.028308
H -4.836569 -2.293493 1.120074
H -4.776507 -1.417709 -1.687958
H -3.385534 -0.338160 -1.964020
H -3.721374 0.551815 1.575516
H -5.420887 0.028104 1.746607
H -0.647970 -3.081484 -0.235074
H -0.650346 2.411652 1.084925
H 1.036969 3.020386 1.262097
H 4.597885 0.018016 1.122556
H 4.334408 -1.731040 0.755479
H 1.229161 3.223775 -1.230976
H -0.436629 2.607602 -1.423881
H 4.359487 -1.208795 -1.703846
H 4.619381 0.521639 -1.339707
H -1.331431 4.611134 -0.137157
H 0.336382 5.231466 0.055590
H -0.400306 5.132755 -1.567436
H 6.835143 -0.040417 -0.228545
H 6.574172 -1.775010 -0.581155
H 6.809652 -0.615299 -1.918643


