%chk=000016107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016107

0 1
 O   -3.445400      -1.456600      2.8800000E-02
 O   -2.741400       2.641800      0.9121000    
 O   -1.222200      -1.625500       1.557800    
 O    3.323100     -0.7795000      -1.389900    
 O    2.879100       1.813400       1.067000    
 O    4.666500       1.230700     -0.2045000    
 N   4.9899999E-02  -1.630400     -0.3826000    
 C   -2.381500      0.6748000     -0.5060000    
 C   -2.254400     -0.8776000     -0.4980000    
 C   -2.625500       1.223000      0.9214000    
 C   -1.121800       1.329600      -1.107000    
 C   -3.580900       1.066100      -1.402100    
 C   -1.102700      -1.407500      0.3535000    
 C    1.264800      -2.154900      0.1973000    
 C    2.170900      -1.032900      0.7043000    
 C    2.615700     -6.0899999E-02 -0.3907000    
 C    3.506000       1.046400      0.1387000    
 H   -2.148900      -1.253000      -1.522700    
 H   -3.556800      0.8353000       1.345100    
 H   -1.812000      0.9621000       1.605600    
 H   -1.276900       2.393500      -1.318400    
 H  -0.8393000      0.8509000      -2.051100    
 H  -0.2762000       1.257200     -0.4172000    
 H   -3.678500       2.153500      -1.495000    
 H   -4.525500      0.6862000     -0.9976000    
 H   -3.462700      0.6605000      -2.413500    
 H    1.766300      -2.750700     -0.5719000    
 H    1.007300      -2.823500       1.026000    
 H   5.6299999E-02  -1.417700      -1.375700    
 H    3.057000      -1.493400       1.159400    
 H    1.656200     -0.4819000       1.501100    
 H   -3.505800      -1.239700      0.9739000    
 H    1.758900      0.4112000     -0.8784000    
 H   -1.852800       3.010900      0.7750000    
 H    3.491600     -0.1682000      -2.127400    
 H    3.464200       2.520800       1.412600    


%chk=000016107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016107

0 1
O -3.509042 -1.410107 0.299895
O -2.652355 2.794890 0.844901
O -1.116521 -1.625765 1.501661
O 3.285323 -0.636536 -1.494037
O 3.072051 1.824007 1.219575
O 4.882719 1.026663 -0.009203
N 0.032363 -1.534199 -0.514834
C -2.512026 0.709472 -0.562852
C -2.380325 -0.855645 -0.446057
C -2.600372 1.322955 0.866321
C -1.309183 1.311344 -1.332003
C -3.821408 1.013465 -1.334266
C -1.090963 -1.351852 0.254131
C 1.279237 -2.092841 0.044134
C 2.190608 -1.030538 0.697658
C 2.670853 0.015792 -0.341385
C 3.663508 0.991615 0.280900
H -2.432499 -1.275525 -1.471128
H -3.547547 1.018451 1.337966
H -1.758835 0.970647 1.498023
H -1.516600 2.365950 -1.587946
H -1.137981 0.782449 -2.290025
H -0.371643 1.275052 -0.744404
H -4.055063 2.090177 -1.258385
H -4.658729 0.436897 -0.905511
H -3.726926 0.747720 -2.404662
H 1.826088 -2.592478 -0.772617
H 0.999546 -2.838752 0.808235
H -0.009568 -1.331441 -1.515089
H 3.067836 -1.546733 1.133009
H 1.650387 -0.522334 1.516285
H -3.156270 -1.624234 1.211694
H 1.797071 0.586977 -0.708012
H -1.750259 3.145007 0.636804
H 4.267575 -0.475044 -1.453752
H 3.751551 2.428494 1.624877


