%chk=000108729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108729

0 1
 O   0.6054000      -1.730700     -0.6835000    
 O   -2.569900     -0.8208000      0.5451000    
 O  -0.2506000       1.887200      0.7668000    
 O   -4.364700      0.3909000     -0.2322000    
 N  -0.8272000      0.4142000     -0.9304000    
 C    1.416300      0.4081000      3.7500001E-02
 C   4.1400000E-02  0.9700000      4.0000002E-03
 C   -2.178200      0.8660000      -1.099900    
 C    1.627500     -0.9114000     -0.3073000    
 C    2.449200       1.241300      0.4189000    
 C    2.925900      -1.419800     -0.2693000    
 C    3.747500      0.7330000      0.4569000    
 C    3.985800     -0.5976000      0.1129000    
 C   -3.165900      0.1310000     -0.2244000    
 C   -3.442500      -1.561500       1.404900    
 H   -2.236600       1.933500     -0.8668000    
 H   -2.449700      0.6957000      -2.145700    
 H  -0.5062000     -0.3262000      -1.546100    
 H    2.282700       2.281100      0.6844000    
 H    3.126400      -2.454300     -0.5349000    
 H    4.573300       1.373500      0.7529000    
 H    4.996900     -0.9931000      0.1421000    
 H   0.9625000      -2.612800     -0.8845000    
 H   -2.838700      -2.285000       1.959300    
 H   -4.185900      -2.104200      0.8134000    
 H   -3.929800     -0.8905000       2.118600    


%chk=000108729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108729

0 1
O 0.685130 -1.670864 0.344272
O -2.926150 -1.122818 0.304861
O 0.214417 2.469573 -0.559614
O -4.535922 0.533721 0.001661
N -0.859048 0.477558 -0.076833
C 1.613407 0.519178 -0.186593
C 0.280459 1.223196 -0.287344
C -2.162166 1.128891 -0.168674
C 1.817118 -0.856505 0.113315
C 2.764513 1.317115 -0.414825
C 3.117842 -1.407708 0.181991
C 4.065619 0.782579 -0.350584
C 4.242101 -0.588626 -0.050028
C -3.335700 0.188372 0.046176
C -4.018210 -2.102785 0.525169
H -2.247420 1.953430 0.567334
H -2.290185 1.617327 -1.154979
H -0.795880 -0.524476 0.141182
H 2.585343 2.372996 -0.644029
H 3.250766 -2.472476 0.415837
H 4.933544 1.424052 -0.532004
H 5.246953 -1.021078 0.004278
H 0.945005 -2.603767 0.538618
H -3.506991 -3.054573 0.725031
H -4.651801 -2.171179 -0.374605
H -4.637844 -1.793534 1.383089


