%chk=000027359.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027359

0 1
 O    3.223800      0.7178000       1.089600    
 O   -2.912800      -3.924100      8.8600002E-02
 N    5.717200      -1.327500     -0.6912000    
 C   -2.084800       2.416100      0.2147000    
 C   -2.772900       1.621300     -0.9407000    
 C  -0.6496000       1.956800      0.4510000    
 C   -2.810600      0.1221000     -0.6621000    
 C   -2.105400       3.934600     -1.7300000E-02
 C   -4.193700       2.123000      -1.239900    
 C  -0.3137000       1.437700       1.682500    
 C   0.2626000       2.076600     -0.5750000    
 C   -3.486700     -0.3290000      0.4508000    
 C   -2.167500     -0.7306000      -1.532900    
 C   0.9988000       1.017900       1.898800    
 C    1.575100       1.656800     -0.3589000    
 C    1.943300       1.127400      0.8780000    
 C   -3.521400      -1.699900      0.7056000    
 C   -2.202200      -2.101600      -1.278400    
 C   -2.879000      -2.586400     -0.1591000    
 C    3.945100      0.2309000     -4.1099999E-02
 C    4.967400     -0.7893000      0.4339000    
 C    6.673600      -2.341100     -0.2393000    
 C    6.415800     -0.2577000      -1.407900    
 C   -3.622300      -4.351800       1.250400    
 H   -2.655400       2.250700       1.138900    
 H   -2.201100       1.785200      -1.864400    
 H   -1.682700       4.205100     -0.9910000    
 H   -1.529500       4.459000      0.7543000    
 H   -3.126800       4.325900      2.5300000E-02
 H   -4.174900       3.137200      -1.651800    
 H   -4.819800       2.137300     -0.3412000    
 H   -4.688600       1.485400      -1.981800    
 H   -1.040300       1.347200       2.483900    
 H  -3.4000000E-03   2.495300      -1.540300    
 H   -3.995600      0.3459000       1.131600    
 H   -1.637300     -0.3647000      -2.406700    
 H    1.279700      0.6059000       2.864200    
 H    2.284700       1.786200      -1.170700    
 H   -4.065600      -2.008400       1.591700    
 H   -1.699800      -2.787100      -1.955400    
 H    3.278500     -0.2592000     -0.7635000    
 H    4.419900       1.100500     -0.5058000    
 H    4.434200      -1.595200      0.9549000    
 H    5.625800     -0.3302000       1.183900    
 H    7.422900      -1.926200      0.4447000    
 H    6.153900      -3.158800      0.2725000    
 H    7.194200      -2.788300      -1.093500    
 H    7.095800     -0.6822000      -2.156800    
 H    5.725100      0.3690000      -1.980400    
 H    7.011700      0.3746000     -0.7398000    
 H   -3.545800      -5.443300       1.292200    
 H   -3.164700      -3.963800       2.166800    
 H   -4.688100      -4.108400       1.183200    


%chk=000027359-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000027359

0 1
O 3.137906 -0.086379 0.776926
O -3.614202 -3.950825 0.422814
N 6.476699 -0.776585 -0.745758
C -2.054190 2.390554 0.119818
C -2.922956 1.631331 -0.954215
C -0.671408 1.747781 0.263402
C -3.126717 0.164581 -0.562370
C -1.934290 3.908051 -0.179470
C -4.280527 2.332578 -1.222491
C -0.304038 1.060917 1.449916
C 0.284953 1.812575 -0.779356
C -3.934074 -0.200153 0.542265
C -2.506490 -0.880431 -1.296389
C 0.962109 0.462630 1.594457
C 1.562114 1.220091 -0.657184
C 1.902068 0.540086 0.538694
C -4.127632 -1.551296 0.910528
C -2.684710 -2.232812 -0.949596
C -3.498297 -2.573491 0.158076
C 4.148843 -0.034914 -0.291848
C 5.361379 -0.818448 0.229297
C 7.356343 -1.960430 -0.666441
C 7.247983 0.482791 -0.689656
C -4.434466 -4.348307 1.566988
H -2.578278 2.281375 1.092215
H -2.347011 1.647691 -1.902938
H -1.526771 4.090298 -1.192198
H -1.252436 4.387981 0.545306
H -2.913124 4.414569 -0.112895
H -4.139514 3.329504 -1.675398
H -4.861755 2.464066 -0.289995
H -4.893248 1.727704 -1.914753
H -1.027594 0.985458 2.270831
H 0.040610 2.338196 -1.710980
H -4.433015 0.578455 1.132582
H -1.864608 -0.628167 -2.149103
H 1.241521 -0.070008 2.508815
H 2.271705 1.292808 -1.486957
H -4.761524 -1.790229 1.770131
H -2.203208 -3.036808 -1.514718
H 3.763413 -0.505796 -1.217289
H 4.408095 1.021278 -0.510422
H 5.053608 -1.869244 0.375553
H 5.649893 -0.420137 1.232637
H 7.907216 -2.044199 0.304773
H 6.760385 -2.879690 -0.803643
H 8.106165 -1.917259 -1.477122
H 7.987572 0.500904 -1.510008
H 6.580183 1.351413 -0.821906
H 7.797301 0.615511 0.277311
H -4.380050 -5.446779 1.593081
H -4.036332 -3.933160 2.513916
H -5.488497 -4.031033 1.439864


