%chk=000025299.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025299

0 1
 O   0.1103000       1.429300      -1.863000    
 O  -0.1111000      -1.429500      -1.862500    
 N   -1.604600       3.752000      0.1135000    
 N    1.603900      -3.752100      0.1136000    
 C   -1.098700       1.166700      0.2395000    
 C    1.098900      -1.166500      0.2393000    
 C   -2.372500      0.3498000      0.3121000    
 C    2.372700     -0.3497000      0.3121000    
 C  -0.2311000      0.7219000     -0.9254000    
 C   0.2310000     -0.7219000     -0.9254000    
 C   -2.912200      5.1600002E-02   1.550300    
 C    2.912400     -5.1500000E-02   1.550300    
 C   -2.965800     -7.9099998E-02 -0.8614000    
 C    2.966100      7.9000004E-02 -0.8615000    
 C   -4.084900     -0.7008000       1.617200    
 C    4.085100      0.7008000       1.617100    
 C   -4.138500     -0.8315000     -0.7946000    
 C    4.138800      0.8314000     -0.7947000    
 C   -4.698100      -1.142200      0.4447000    
 C    4.698400       1.142100      0.4446000    
 C   -1.382900       2.614100      0.1671000    
 C    1.382900      -2.614000      0.1671000    
 H  -0.5058000       1.001400       1.147800    
 H   0.5061000      -1.001200       1.147700    
 H   -2.442500      0.3916000       2.468600    
 H    2.442600     -0.3913000       2.468700    
 H   -2.569400      0.1683000      -1.841200    
 H    2.569600     -0.1685000      -1.841300    
 H   -4.520900     -0.9423000       2.582100    
 H    4.521100      0.9425000       2.582000    
 H   -4.619400      -1.170500      -1.707600    
 H    4.619700       1.170200      -1.707700    
 H   -5.612000      -1.726700      0.4967000    
 H    5.612300       1.726500      0.4966000    


%chk=000025299-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025299

0 1
O 0.002338 1.439158 -2.510759
O -0.001840 -1.440253 -2.510596
N -1.597426 3.863919 -0.494726
N 1.598838 -3.864290 -0.494316
C -0.866667 1.316317 -0.199403
C 0.867099 -1.316940 -0.199247
C -2.053053 0.432840 0.229298
C 2.053166 -0.432973 0.229316
C -0.191973 0.758208 -1.484762
C 0.192101 -0.759194 -1.484601
C -2.180587 0.019357 1.578030
C 2.180642 -0.019376 1.578019
C -3.029523 0.040919 -0.720255
C 3.029406 -0.040709 -0.720331
C -3.273174 -0.783157 1.974711
C 3.272944 0.783587 1.974578
C -4.118604 -0.764933 -0.322343
C 4.118201 0.765591 -0.322541
C -4.242246 -1.179544 1.023829
C 4.241786 1.180311 1.023602
C -1.263759 2.725913 -0.376458
C 1.264722 -2.726399 -0.376209
H -0.097072 1.287552 0.600427
H 0.097538 -1.288406 0.600622
H -1.442303 0.343874 2.322423
H 1.442542 -0.344147 2.322484
H -2.946211 0.368292 -1.763629
H 2.946144 -0.368163 -1.763684
H -3.370147 -1.094199 3.020280
H 3.369877 1.094715 3.020125
H -4.867866 -1.067804 -1.061021
H 4.867286 1.068723 -1.061291
H -5.088050 -1.803846 1.330574
H 5.087370 1.804958 1.330254


