%chk=000088304.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088304

0 1
 O    2.933700      -2.314900     -0.2058000    
 O    2.897900       2.317100     -0.3049000    
 O   -2.939700       2.310800     -0.2399000    
 O   -2.892000      -2.322100     -0.2706000    
 N    2.460300      2.9000000E-03 -2.0999999E-03
 N   -2.460400     -2.4999999E-03 -2.0000001E-03
 C  -9.9999997E-05  1.7000000E-03 -4.3000001E-03
 C    1.207900      8.2999999E-03  0.6930000    
 C   -1.208000      5.5999998E-03  0.6932000    
 C    1.208100      1.8600000E-02   2.087900    
 C   -1.207800      1.5799999E-02   2.088100    
 C  -3.0000001E-04 -9.4999997E-03  -1.502200    
 C   3.0000001E-04  2.2500001E-02   2.785400    
 C    3.156000      -1.127900     -0.3800000    
 C    3.156000       1.128100     -0.3969000    
 C   -3.158900       1.120800     -0.3965000    
 C   -3.153100      -1.135100     -0.3801000    
 C    4.373100     -0.6696000      -1.065500    
 C    4.378600      0.6597000      -1.065700    
 C   -4.374800      0.6493000      -1.075300    
 C   -4.376900     -0.6797000      -1.055800    
 H    2.143300      2.3399999E-02   2.642000    
 H   -2.142800      1.8500000E-02   2.642400    
 H  -0.4596000     -0.9337000      -1.869600    
 H  -0.5652000      0.8465000      -1.887100    
 H   0.9914000      5.1300000E-02  -1.955600    
 H   3.0000001E-04  3.0400001E-02   3.871500    
 H    5.122800      -1.323000      -1.479100    
 H    5.130000       1.306800      -1.486000    
 H   -5.126200       1.294700      -1.498400    
 H   -5.126600      -1.334900      -1.466500    


%chk=000088304-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088304

0 1
O 2.282895 -2.221495 -0.916187
O 3.461770 2.101833 0.547428
O -3.450420 2.120300 0.552885
O -2.298683 -2.210234 -0.910896
N 2.479820 -0.005578 -0.031395
N -2.481700 0.006781 -0.026339
C -0.000816 0.024883 -0.101412
C 1.211181 0.124304 0.639237
C -1.211086 0.130166 0.641798
C 1.219038 0.379946 2.028948
C -1.215098 0.385980 2.031297
C -0.002691 -0.147539 -1.604041
C 0.003076 0.529486 2.723092
C 2.929524 -1.163125 -0.744931
C 3.518172 0.983334 -0.013175
C -3.514901 1.002028 -0.006853
C -2.939266 -1.148341 -0.737780
C 4.323956 -0.846247 -1.219773
C 4.665338 0.399740 -0.795768
C -4.667017 0.423646 -0.785731
C -4.333162 -0.824381 -1.209710
H 2.174827 0.468252 2.553537
H -2.169445 0.478630 2.557791
H -0.006707 -1.219079 -1.873257
H -0.894115 0.321116 -2.054654
H 0.891650 0.314247 -2.056028
H 0.004688 0.738040 3.797073
H 4.904181 -1.563806 -1.800191
H 5.591720 0.953942 -0.947572
H -5.590978 0.982431 -0.935561
H -4.918451 -1.539362 -1.788231


