%chk=000077980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077980

0 1
 O   -1.769400      -1.049500     -0.9426000    
 O   -3.713600      -1.197100      0.2883000    
 N    1.524400       1.399700      -1.471800    
 N   -3.566900       1.373000       1.025800    
 C   9.6199997E-02  0.9803000      0.1748000    
 C   -1.116500      0.9998000       1.017900    
 C    1.284700      0.2360000      0.4165000    
 C   -2.442300      0.8821000      0.2273000    
 C    2.164400      0.5171000     -0.6312000    
 C   0.2740000       1.685600     -0.9930000    
 C    1.697800     -0.6526000       1.429000    
 C    3.441700     -4.8200000E-02 -0.7172000    
 C   -2.739700     -0.5696000     -0.1082000    
 C    2.972700      -1.225500       1.356100    
 C    3.829600     -0.9266000      0.2986000    
 C   -1.937100      -2.404600      -1.370200    
 H   -1.073900      0.2083000       1.776800    
 H   -1.106600       1.951100       1.568300    
 H   -2.434900       1.451800     -0.7074000    
 H  -0.3686000       2.370400      -1.528500    
 H    1.921500       1.782000      -2.318900    
 H    1.044600     -0.8979000       2.261400    
 H    4.109400      0.1839000      -1.540000    
 H   -3.423800       2.359400       1.240900    
 H   -3.584800      0.8937000       1.925800    
 H    3.296800      -1.911500       2.134200    
 H    4.815500      -1.383100      0.2618000    
 H   -1.099900      -2.659900      -2.025300    
 H   -2.869200      -2.511700      -1.933100    
 H   -1.925600      -3.077700     -0.5077000    


%chk=000077980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077980

0 1
O -1.831894 -1.110914 -0.984578
O -2.272244 -1.395422 1.285121
N 1.782431 1.750845 -1.405481
N -3.677645 1.075683 1.053354
C 0.104420 1.417944 0.118060
C -1.177364 1.581320 0.894026
C 1.080680 0.345842 0.252903
C -2.444165 0.848682 0.286587
C 2.121755 0.581837 -0.714863
C 0.571545 2.249797 -0.900633
C 1.179251 -0.788466 1.103869
C 3.238561 -0.272758 -0.850945
C -2.191927 -0.656627 0.272378
C 2.291731 -1.642945 0.974381
C 3.309892 -1.389187 0.006959
C -1.443642 -2.542409 -1.072748
H -1.057709 1.216433 1.932837
H -1.450978 2.652812 0.957626
H -2.575889 1.191578 -0.754061
H 0.132591 3.162871 -1.300135
H 2.331951 2.178853 -2.146836
H 0.402311 -0.999541 1.847223
H 4.024151 -0.080614 -1.590616
H -3.921165 2.060573 1.186351
H -3.725274 0.521120 1.914529
H 2.382475 -2.517493 1.628311
H 4.163352 -2.072445 -0.068305
H -1.353854 -2.741847 -2.149473
H -2.214982 -3.177576 -0.606659
H -0.477867 -2.689245 -0.560782


