%chk=000133373.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133373

0 1
 O   0.8178000       1.303100      -1.710900    
 O   -1.239600       1.896800       1.622400    
 O   -6.736800      0.5327000       1.646100    
 O   -6.734100       1.367900     -0.4656000    
 N   -1.609900       1.098900     -0.5250000    
 N    1.657500     -0.1491000     -6.9899999E-02
 N    7.168700      0.6667000     -0.4273000    
 C  -0.7263000     -3.9200000E-02 -0.4336000    
 C   -1.214600      -1.172400      -1.343900    
 C   -2.375200      -1.946700     -0.7687000    
 C   0.6653000      0.4500000     -0.8406000    
 C   -2.793600       3.071100      0.1818000    
 C   -1.792300       1.982400      0.5292000    
 C   -4.181900       2.539600     -0.1697000    
 C    3.055400      5.1199999E-02 -0.1529000    
 C   -2.139500      -3.065300      3.0700000E-02
 C   -3.683700      -1.543600      -1.036000    
 C   -4.807300       1.740500      0.9756000    
 C    3.913300     -0.6351000      0.7018000    
 C    5.302600     -0.4394000      0.6223000    
 C    3.580700      0.9341000      -1.088200    
 C   -3.212100      -3.781000      0.5625000    
 C   -4.756300      -2.259400     -0.5039000    
 C    5.842800      0.4556000     -0.3248000    
 C    4.961900       1.128800      -1.166800    
 C   -4.520400      -3.378000      0.2953000    
 C   -6.177500       1.215200      0.6128000    
 C    6.188900      -1.116700       1.470400    
 C    7.555600     -0.9014000       1.367200    
 C    7.990300     -7.3000002E-03  0.4099000    
 H  -0.7026000     -0.3704000      0.6121000    
 H  -0.3911000      -1.875200      -1.530700    
 H   -1.485700     -0.7873000      -2.336600    
 H   -2.032600       1.306300      -1.425100    
 H   -2.860000       3.756100       1.035200    
 H   -2.392900       3.645900     -0.6616000    
 H   -4.830700       3.389200     -0.4172000    
 H   -4.138900       1.918000      -1.071900    
 H    1.365200     -0.8248000      0.6325000    
 H   -1.124700      -3.387400      0.2483000    
 H   -3.881500     -0.6751000      -1.658100    
 H   -4.909100       2.380100       1.859200    
 H   -4.181200      0.8786000       1.228800    
 H    3.504500      -1.327500       1.435700    
 H    2.987400       1.503100      -1.790000    
 H   -3.028700      -4.651500       1.185600    
 H   -5.775000      -1.945100     -0.7114000    
 H    5.349800       1.825200      -1.908200    
 H   -5.355600      -3.934700      0.7100000    
 H    5.819000      -1.816300       2.216500    
 H    8.255100      -1.416700       2.014800    
 H    9.047500      0.2012000      0.2831000    
 H   -7.625200      0.1859000       1.416400    


%chk=000133373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133373

0 1
O 1.076452 -0.897868 -2.533454
O -0.147433 0.328625 1.692776
O -6.486408 0.625851 1.902968
O -6.013212 1.820560 -0.029017
N -1.279146 0.300222 -0.324981
N 1.672014 -0.438133 -0.291579
N 7.219313 0.688344 -0.543385
C -0.668765 -0.974821 -0.774545
C -1.546724 -1.644337 -1.857005
C -2.970156 -1.898989 -1.382492
C 0.786138 -0.762066 -1.306905
C -1.790257 2.108647 1.305114
C -1.027540 0.842257 0.913323
C -3.264180 2.217656 0.849376
C 3.060939 -0.155325 -0.380681
C -3.235580 -2.863427 -0.374360
C -4.058401 -1.165391 -1.919348
C -4.170348 1.138897 1.479450
C 3.722496 0.226640 0.799134
C 5.118210 0.518146 0.789115
C 3.792833 -0.253638 -1.616779
C -4.551612 -3.085955 0.085703
C -5.378634 -1.380001 -1.458185
C 5.858317 0.419507 -0.455080
C 5.157230 0.029383 -1.639925
C -5.628591 -2.341301 -0.453019
C -5.607147 1.256304 1.011614
C 5.846072 0.912061 1.961339
C 7.212270 1.179520 1.861463
C 7.856215 1.053987 0.586488
H -0.606899 -1.622265 0.122809
H -1.048262 -2.588833 -2.140088
H -1.533596 -1.015394 -2.765544
H -1.980459 0.730197 -0.932549
H -1.719400 2.173043 2.405265
H -1.219324 2.971595 0.906489
H -3.638822 3.217951 1.136527
H -3.360744 2.181309 -0.253097
H 1.223928 -0.306917 0.640384
H -2.408052 -3.449585 0.045550
H -3.876241 -0.430778 -2.714375
H -4.149489 1.187822 2.582924
H -3.822696 0.121132 1.207919
H 3.163053 0.304670 1.740426
H 3.258666 -0.548159 -2.521833
H -4.739421 -3.838163 0.860003
H -6.202708 -0.795971 -1.881951
H 5.732732 -0.039060 -2.568150
H -6.649417 -2.515005 -0.095497
H 5.322478 0.998111 2.920829
H 7.798491 1.482031 2.735020
H 8.929308 1.260523 0.491056
H -7.414790 0.693989 1.548360


