%chk=000005898.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005898

0 1
 O    2.085500      -1.995800      0.9714000    
 O   -3.150000      -1.192700     -0.2158000    
 O   -2.970600       1.439000      0.3102000    
 N    1.811500      0.9869000     -5.0900001E-02
 C    1.750700      -1.364300     -0.2602000    
 C    2.658900     -0.1366000     -0.4481000    
 C   0.3615000     -0.7916000     -0.1754000    
 C   0.4748000      0.6446000      3.1000001E-03
 C  -0.7940000      -1.454400     -0.2670000    
 C  -0.6025000       1.422500      0.1656000    
 C    2.362600       2.323500     -3.9999999E-02
 C   -2.044200     -0.6813000     -0.1294000    
 C   -1.944000      0.8003000      0.1364000    
 H    1.866200      -2.087400      -1.073700    
 H    3.567500     -0.1843000      0.1615000    
 H    2.934600     -2.3100000E-02  -1.503100    
 H  -0.8488000      -2.525000     -0.4168000    
 H  -0.5395000       2.495200      0.3006000    
 H    2.185200       2.817200      -1.000800    
 H    3.442900       2.301600      0.1386000    
 H    1.911600       2.927900      0.7538000    
 H    2.998100      -2.322300      0.8927000    


%chk=000005898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005898

0 1
O 2.065166 -2.454434 0.580296
O -3.132277 -1.294135 0.159663
O -3.026641 1.535583 0.136691
N 1.826740 1.050146 -0.241756
C 1.834247 -1.345290 -0.341784
C 2.741811 -0.102949 -0.068427
C 0.427720 -0.793529 -0.167162
C 0.493810 0.680782 -0.156820
C -0.749683 -1.465649 -0.036295
C -0.633701 1.483150 -0.061737
C 2.295247 2.431988 -0.175730
C -2.020218 -0.701254 0.067673
C -1.947780 0.866183 0.043513
H 1.965192 -1.677629 -1.393881
H 3.120900 -0.164327 0.972576
H 3.600749 -0.023588 -0.759266
H -0.803476 -2.558519 -0.008954
H -0.586631 2.575596 -0.030733
H 1.668456 3.073785 -0.819223
H 3.335528 2.489353 -0.536862
H 2.258396 2.833466 0.857961
H 2.784445 -3.038830 0.232957


