%chk=000170509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170509

0 1
 O   -2.904400     -0.7714000     -1.9999999E-04
 O    3.296000     -0.2373000     -1.9999999E-04
 O   -3.600500       1.422800      7.9999998E-04
 O    1.820900      -2.004400      3.0000000E-03
 N    1.452500       1.515300     -3.0000001E-04
 C   -1.274200      0.8998000      1.9999999E-04
 C  -0.3285000     -0.1196000      5.0000002E-04
 C    1.010200      0.2379000      3.0000001E-04
 C  -0.8581000       2.226600     -3.0000001E-04
 C   -2.693100      0.5804000      6.9999998E-04
 C    2.041500     -0.7851000      1.6000000E-03
 C   -4.266200      -1.213300     -1.0000000E-03
 C   0.5043000       2.479000     -3.9999999E-04
 C    4.401100      -1.147500     -3.9999999E-04
 C   -4.293300      -2.726900     -1.8000000E-03
 C    5.691700     -0.3562000     -2.4000001E-03
 H  -0.6064000      -1.168300      1.2000001E-03
 H   -1.561800       3.052100     -5.0000002E-04
 H   -4.772300     -0.8329000      0.8930000    
 H   -4.771500     -0.8320000     -0.8951000    
 H    4.352900      -1.777800      0.8943000    
 H    4.351200      -1.779600     -0.8938000    
 H   0.8809000       3.496600     -7.9999998E-04
 H   -5.321200      -3.099800     -2.4999999E-03
 H   -3.773300      -3.121000     -0.8813000    
 H   -3.774100      -3.122000      0.8777000    
 H    6.558900      -1.022200     -2.7000001E-03
 H    5.744000      0.2932000     -0.8826000    
 H    5.745800      0.2948000      0.8764000    


%chk=000170509-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170509

0 1
O -2.960357 -0.806587 -0.001693
O 3.417346 -0.196610 -0.001723
O -3.686964 1.410162 0.000462
O 1.869760 -1.936803 -0.002858
N 1.443844 1.678346 -0.000662
C -1.298190 0.914323 -0.001645
C -0.280047 -0.066018 -0.002580
C 1.070294 0.361978 -0.002105
C -0.927096 2.281265 -0.000163
C -2.755936 0.567836 -0.002193
C 2.133975 -0.705760 -0.003297
C -4.388344 -1.260985 0.000122
C 0.447244 2.608936 0.000228
C 4.518118 -1.213480 -0.001060
C -4.363379 -2.784777 0.000440
C 5.826784 -0.432150 0.000693
H -0.511951 -1.133121 -0.003743
H -1.700972 3.054464 0.000605
H -4.879817 -0.839904 0.895683
H -4.881922 -0.840306 -0.894470
H 4.398130 -1.851629 0.893280
H 4.399986 -1.850736 -0.896284
H 0.772788 3.654716 0.001367
H -5.398117 -3.172995 0.001742
H -3.848843 -3.171957 -0.895131
H -3.846740 -3.171552 0.894973
H 6.680841 -1.133855 0.001209
H 5.902203 0.209663 -0.893105
H 5.900362 0.208736 0.895308


