%chk=000096694.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096694

0 1
 O   -2.575800       1.922200      0.1341000    
 O    3.818800      0.8154000     -0.4413000    
 N    2.238100     -0.8344000      0.1403000    
 C   -1.371000     -0.1259000      0.4494000    
 C    1.025200     -0.1450000      0.1415000    
 C   -2.628600     -0.8596000      0.7804000    
 C  -0.1586000     -0.8156000      0.4493000    
 C   -1.399800       1.234200      0.1418000    
 C   0.9966000       1.215100     -0.1662000    
 C  -0.2159000       1.904800     -0.1660000    
 C   -3.298200      -1.454900     -0.4302000    
 C    3.516800     -0.3352000     -0.1415000    
 C    4.571900      -1.407400     -3.4400001E-02
 C   -4.519400      -1.113900     -0.8573000    
 H   -2.406600      -1.673900       1.482900    
 H   -3.317600     -0.2035000       1.327800    
 H  -0.1359000      -1.876900      0.6873000    
 H    1.870000       1.801500     -0.4148000    
 H  -0.2249000       2.964400     -0.4081000    
 H    2.176000      -1.823200      0.3743000    
 H   -2.753400      -2.221000     -0.9769000    
 H   -2.399800       2.849100     -0.1023000    
 H    5.551000     -0.9905000     -0.2857000    
 H    4.345100      -2.222000     -0.7280000    
 H    4.602000      -1.795000      0.9878000    
 H   -4.947200      -1.587900      -1.733800    
 H   -5.108800     -0.3613000     -0.3456000    


%chk=000096694-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096694

0 1
O -2.687752 1.872722 0.233775
O 3.866249 0.811188 -0.407378
N 2.285125 -0.833827 0.149694
C -1.387001 -0.144161 0.473226
C 1.067640 -0.087297 0.143450
C -2.670587 -0.915339 0.757334
C -0.131337 -0.785307 0.449159
C -1.425002 1.247408 0.185751
C 1.008884 1.299556 -0.146796
C -0.239855 1.953369 -0.119164
C -3.329775 -1.413344 -0.523209
C 3.580529 -0.388166 -0.111170
C 4.657641 -1.468229 -0.014175
C -4.584828 -1.095293 -0.924541
H -2.431364 -1.784516 1.402702
H -3.382623 -0.274399 1.304977
H -0.091094 -1.859190 0.680167
H 1.927290 1.839211 -0.381807
H -0.282508 3.028692 -0.337932
H 2.186637 -1.825279 0.377475
H -2.709557 -2.070710 -1.152108
H -2.608617 2.832170 0.007683
H 5.179591 -1.541441 -0.983940
H 4.272488 -2.466745 0.257933
H 5.406146 -1.160012 0.736024
H -5.005862 -1.487466 -1.857558
H -5.220459 -0.423996 -0.334770


