%chk=000038224.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038224

0 1
 O    1.139600      -1.005600      -1.808900    
 O  -0.4882000      -1.933400      0.9130000    
 N   -1.135100     -0.1427000     -0.4530000    
 C    1.211800     -0.8046000     -0.3945000    
 C    2.176100      -1.872300      0.1827000    
 C    1.674200      0.6109000     -5.1399998E-02
 C    3.616000      -1.760200     -0.3374000    
 C  -0.2290000      -1.035000      0.1160000    
 C    4.503000      -2.845900      0.2539000    
 C    1.720000      0.9883000       1.272100    
 C    2.028800       1.457600      -1.077700    
 C    2.142200       2.280300       1.585600    
 C    2.451100       2.749400     -0.7641000    
 C   -2.528200     -5.7500001E-02 -0.2237000    
 C    2.507900       3.160700      0.5676000    
 C   -3.267400      0.9062000     -0.8901000    
 C   -3.125100     -0.9398000      0.6621000    
 C   -4.641300      0.9902000     -0.6644000    
 C   -4.499100     -0.8558000      0.8877000    
 C   -5.257200      0.1092000      0.2245000    
 H    2.186300      -1.830300       1.279500    
 H    1.802200      -2.871600     -8.0799997E-02
 H    4.044600     -0.7860000     -7.9099998E-02
 H    3.630100      -1.844200      -1.429800    
 H    4.133200      -3.841800     -1.0100000E-02
 H    4.540400      -2.770600       1.345300    
 H    5.524100      -2.750600     -0.1284000    
 H    1.434900      0.3156000       2.074700    
 H    1.999100       1.168900      -2.122800    
 H   0.9226000      -1.939200      -1.973100    
 H  -0.7697000      0.5297000      -1.123600    
 H    2.185400       2.600900       2.622400    
 H    2.736500       3.435300      -1.556500    
 H    2.836600       4.166700      0.8117000    
 H   -2.797700       1.597400      -1.584400    
 H   -2.609400      -1.711000       1.214500    
 H   -5.231700       1.741500      -1.180700    
 H   -4.980000      -1.540900       1.580000    
 H   -6.326900      0.1746000      0.4003000    


%chk=000038224-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038224

0 1
O 1.017833 -0.525590 -1.822357
O -0.358056 -1.070422 1.526765
N -1.261361 -0.344413 -0.530013
C 1.183774 -0.561684 -0.345129
C 2.053708 -1.778860 0.069765
C 1.804943 0.780714 0.080314
C 3.511085 -1.728559 -0.438197
C -0.231704 -0.696388 0.320804
C 4.293778 -3.003363 -0.056490
C 1.940063 1.087216 1.459353
C 2.263437 1.708795 -0.884976
C 2.534556 2.302702 1.862128
C 2.856525 2.925717 -0.477533
C -2.657556 -0.286156 -0.270831
C 2.997245 3.226895 0.896002
C -3.502771 0.135174 -1.333398
C -3.223694 -0.629773 0.986540
C -4.897012 0.212313 -1.143800
C -4.622231 -0.547067 1.159215
C -5.467167 -0.129544 0.105233
H 2.034790 -1.843792 1.172307
H 1.556599 -2.705387 -0.294330
H 4.014436 -0.839094 -0.015576
H 3.528239 -1.598405 -1.539346
H 3.834937 -3.907067 -0.501102
H 4.313219 -3.143920 1.040541
H 5.340031 -2.948906 -0.408184
H 1.562252 0.384704 2.210730
H 2.152729 1.466250 -1.944888
H 1.099711 -1.450458 -2.166281
H -0.934478 -0.097178 -1.474193
H 2.631818 2.529757 2.929764
H 3.208499 3.636838 -1.233753
H 3.457537 4.170306 1.210762
H -3.065555 0.406396 -2.302906
H -2.568275 -0.951283 1.798161
H -5.537095 0.540458 -1.970281
H -5.053404 -0.812710 2.131099
H -6.550686 -0.069817 0.253177


