%chk=000095990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095990

0 1
 O   -4.419400      0.6887000      0.1053000    
 O   -2.089000     -0.7932000       2.109100    
 O    4.654300      0.7462000      0.1822000    
 O    3.159000       2.217500     -0.4649000    
 N    3.482300       1.046600     -0.1505000    
 C   0.2239000     -0.6637000     -0.5544000    
 C   -1.157700     -0.3382000     -0.9404000    
 C   -2.150100      4.7499999E-02 -0.1171000    
 C    1.181500      0.3391000     -0.5382000    
 C   0.5453000      -1.968800     -0.2135000    
 C    2.491300      2.9700000E-02 -0.1723000    
 C    1.855300      -2.278500      0.1524000    
 C    2.828100      -1.279200      0.1730000    
 C   -3.517200      0.3472000     -0.6610000    
 C   -1.893700      0.1576000       1.354600    
 C   -3.782900      0.2160000      -2.140000    
 C   -1.410900       1.485600       1.875600    
 H   -1.317500     -0.4341000      -2.010900    
 H   0.8953000       1.352400     -0.8116000    
 H  -0.2036000      -2.756300     -0.2257000    
 H    2.117100      -3.297600      0.4213000    
 H    3.838100      -1.557100      0.4633000    
 H   -3.625500     -0.8160000      -2.463900    
 H   -4.826500      0.4777000      -2.341600    
 H   -3.148900      0.9063000      -2.702300    
 H  -0.4372000       1.352600       2.354100    
 H   -2.135800       1.873900       2.595800    
 H   -1.305200       2.211000       1.063900    


%chk=000095990-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095990

0 1
O -4.493482 0.461098 -0.088221
O -1.902775 -1.412007 1.961314
O 5.112330 0.040679 -1.375172
O 3.547308 1.147253 -2.610998
N 3.892009 0.352924 -1.653248
C 0.427117 -0.454942 -0.313170
C -0.941190 -0.051527 -0.688042
C -2.128837 0.021612 0.011852
C 1.478937 0.086104 -1.107249
C 0.771978 -1.364350 0.734505
C 2.814789 -0.240007 -0.816847
C 2.122374 -1.681404 0.995834
C 3.165152 -1.118915 0.231213
C -3.381405 0.471179 -0.698098
C -2.277513 -0.300892 1.491594
C -3.325946 0.898935 -2.163469
C -2.858335 0.779476 2.384272
H -0.992061 0.314610 -1.723458
H 1.272574 0.768597 -1.938064
H -0.025951 -1.836664 1.312900
H 2.361005 -2.385391 1.799103
H 4.217323 -1.351556 0.414734
H -3.000017 0.068757 -2.816823
H -4.338342 1.205808 -2.466232
H -2.632875 1.745987 -2.319362
H -2.758549 0.479281 3.438690
H -3.924091 0.920841 2.130499
H -2.351124 1.747413 2.214245


