%chk=000083109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083109

1 1
 O    2.898700       1.094000      0.1164000    
 O    3.972400     -0.5858000      -1.034400    
 N  -0.3728000      -1.111000      0.7943000    
 C   -1.468000     -0.5017000       1.543300    
 C   -2.437800      0.1895000      0.6242000    
 C   0.7302000     -0.3876000      0.5583000    
 C    1.786900     -0.9415000     -0.1501000    
 C  -0.5068000      -2.374400      0.3680000    
 C    1.675100      -2.252000     -0.6049000    
 C   -3.515100     -0.5182000      0.1078000    
 C   -2.243200       1.526400      0.3035000    
 C   0.5177000      -2.979800     -0.3455000    
 C    2.987300     -0.1659000     -0.4112000    
 C   -4.414200      0.1225000     -0.7447000    
 C   -3.142200       2.167300     -0.5489000    
 C   -4.227700       1.465300      -1.073000    
 C    4.023600       1.958200     -7.6700002E-02
 C    3.736000       3.294700      0.5736000    
 H   -1.048000      0.1981000       2.276900    
 H   -1.967400      -1.281600       2.132400    
 H   0.7282000      0.6207000      0.9524000    
 H   -1.429300      -2.891800      0.6020000    
 H    2.479100      -2.724000      -1.163400    
 H   -3.672400      -1.563500      0.3579000    
 H   -1.403200       2.084500      0.7071000    
 H   0.4183000      -4.002200     -0.6941000    
 H   -5.259700     -0.4238000      -1.152500    
 H   -2.997400       3.212900     -0.8041000    
 H   -4.927800       1.964400      -1.736500    
 H    4.911500       1.506400      0.3790000    
 H    4.195900       2.096300      -1.149800    
 H    4.577000       3.981600      0.4445000    
 H    2.838600       3.748600      0.1404000    
 H    3.543000       3.168600       1.644000    


%chk=000083109-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083109

1 1
O 3.533505 1.051717 0.471455
O 4.351176 -0.775735 -0.744355
N -0.349710 -0.304126 0.276606
C -1.442447 0.511288 0.988538
C -2.802199 0.390807 0.338319
C 0.947969 0.138979 0.335045
C 1.983186 -0.601473 -0.260430
C -0.670040 -1.476966 -0.364238
C 1.673568 -1.815393 -0.922722
C -3.812367 -0.397403 0.947043
C -3.084464 1.079405 -0.870926
C 0.332088 -2.251291 -0.968829
C 3.415962 -0.135912 -0.215524
C -5.090743 -0.498940 0.352965
C -4.359186 0.972219 -1.466179
C -5.363146 0.182330 -0.855549
C 4.930650 1.626810 0.594671
C 4.819651 2.894921 1.427056
H -1.077639 1.552378 0.987409
H -1.462590 0.147227 2.030855
H 1.147298 1.077219 0.857234
H -1.727165 -1.749694 -0.375967
H 2.486012 -2.385453 -1.384895
H -3.610912 -0.914379 1.893812
H -2.317565 1.708797 -1.339888
H 0.053135 -3.180393 -1.470513
H -5.870156 -1.098604 0.833304
H -4.575749 1.510876 -2.394133
H -6.354460 0.108290 -1.314160
H 5.562059 0.852668 1.064383
H 5.297498 1.810808 -0.430148
H 5.823846 3.341610 1.537691
H 4.168720 3.641296 0.941469
H 4.430713 2.681317 2.436799


