%chk=000015584.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015584

0 1
 O   -1.455700       1.675100     -0.1582000    
 O    1.132000     -0.3073000      0.6776000    
 O   0.8885000     -0.2695000      -1.640800    
 N    6.544500      0.7404000     -5.2099999E-02
 C   -4.211900       1.242800      0.3691000    
 C   -3.238300      0.1251000      0.1876000    
 C   -1.892500      0.3848000     -7.1500003E-02
 C  -0.9980000     -0.6724000     -0.2394000    
 C   -3.689800      -1.191400      0.2790000    
 C   -4.844100       1.248300       1.773100    
 C   -5.317000       1.238800     -0.7031000    
 C   -1.449500      -1.989100     -0.1480000    
 C   -2.795400      -2.248500      0.1112000    
 C  -0.5156000      -3.142400     -0.3226000    
 C   0.4093000     -0.3966000     -0.5082000    
 C   -1.487300       2.282000      -1.447100    
 C    2.492100     -4.3699998E-02  0.4952000    
 C    2.912400       1.267000      0.4557000    
 C    3.358600      -1.105600      0.3608000    
 C    5.171700      0.4750000      0.1327000    
 C    4.269800       1.529800      0.2720000    
 C    4.716200     -0.8426000      0.1771000    
 H   -3.706000       2.210500      0.2763000    
 H   -4.733000      -1.418800      0.4797000    
 H   -5.464300      0.3628000       1.948200    
 H   -5.480700       2.130200       1.904100    
 H   -4.070000       1.274900       2.548100    
 H   -4.885100       1.253300      -1.709800    
 H   -5.955500       2.123000     -0.5990000    
 H   -5.959700      0.3552000     -0.6269000    
 H   -3.164100      -3.268100      0.1860000    
 H  -3.4400001E-02  -3.102900      -1.305400    
 H   0.2525000      -3.135000      0.4577000    
 H   -1.037700      -4.103300     -0.2570000    
 H   -2.475000       2.188300      -1.908800    
 H  -0.7312000       1.838400      -2.100800    
 H   -1.260000       3.345100      -1.328300    
 H    2.209800       2.087400      0.5641000    
 H    3.003600      -2.130700      0.3955000    
 H    4.612300       2.560900      0.2392000    
 H    5.409000      -1.673300      6.9899999E-02
 H    6.875400       1.695500     -8.6000003E-02
 H    7.198600     -2.4100000E-02 -0.1547000    


%chk=000015584-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015584

0 1
O -1.750176 1.935052 -0.068213
O 1.273002 -0.381340 0.185793
O 0.616218 0.950957 -1.633336
N 6.886125 0.316035 0.476741
C -4.510493 1.137070 0.472072
C -3.405538 0.135931 0.128215
C -2.078337 0.558183 -0.152934
C -1.033242 -0.378241 -0.397332
C -3.656900 -1.257466 0.119092
C -5.044184 0.902896 1.910989
C -5.668780 1.089482 -0.560021
C -1.302471 -1.777641 -0.390352
C -2.633891 -2.191013 -0.141882
C -0.224194 -2.814655 -0.655251
C 0.336162 0.152306 -0.707524
C -1.948517 2.709392 -1.314581
C 2.684158 -0.127533 0.159398
C 3.363940 0.734033 -0.734266
C 3.396944 -0.833362 1.154174
C 5.501014 0.168871 0.373674
C 4.761958 0.872832 -0.619491
C 4.790697 -0.690255 1.263401
H -4.062316 2.147006 0.449270
H -4.670898 -1.619277 0.327951
H -5.514119 -0.093836 2.007616
H -5.806075 1.662441 2.167675
H -4.227214 0.967514 2.651358
H -5.304409 1.281733 -1.585937
H -6.434868 1.849113 -0.316624
H -6.164031 0.100255 -0.560413
H -2.864515 -3.262496 -0.147613
H 0.368610 -2.574666 -1.556787
H 0.487785 -2.870022 0.187331
H -0.672917 -3.812416 -0.798179
H -2.993163 2.621726 -1.673811
H -1.243256 2.358390 -2.087720
H -1.730561 3.754300 -1.044828
H 2.813522 1.282833 -1.498506
H 2.844890 -1.485413 1.838191
H 5.287146 1.541254 -1.312647
H 5.333649 -1.241972 2.039985
H 7.392209 0.931995 -0.152072
H 7.411534 -0.180694 1.189588


