%chk=000020043.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020043

0 1
 O    3.452300      5.0000002E-04 -9.9999997E-05
 O    1.419000      -3.513800       0.000000    
 O    1.417700       3.513900     -3.9999999E-04
 O    3.335900      -2.444000     -3.0000001E-04
 O    3.335000       2.444700      9.9999997E-05
 N    2.082300      -2.450000      1.9999999E-04
 N    2.081400       2.450400     -1.9999999E-04
 C  -0.7034000     -1.9999999E-04  9.9999997E-05
 C   -2.150400     -5.0000002E-04 -9.9999997E-05
 C  -6.3000000E-03   1.207800       0.000000    
 C  -5.7999999E-03  -1.208100      3.0000001E-04
 C    1.389100      -1.208000      3.0000001E-04
 C    1.388600       1.208100       0.000000    
 C    2.086400      1.9999999E-04  1.9999999E-04
 C   -2.847900      1.9999999E-04   1.208000    
 C   -2.847900     -6.9999998E-04  -1.208100    
 C   -4.242800      1.9999999E-04   1.207900    
 C   -4.242800     -6.0000003E-04  -1.208000    
 C   -4.940200     -9.9999997E-05   0.000000    
 H  -0.5715000       2.138100     -9.9999997E-05
 H  -0.5708000      -2.138400      3.0000001E-04
 H   -2.319900      6.0000003E-04   2.158600    
 H   -2.319800     -1.1000000E-03  -2.158800    
 H   -4.786000      6.0000003E-04   2.148400    
 H   -4.786000     -7.9999998E-04  -2.148400    
 H   -6.026200       0.000000       0.000000    
 H    3.788600      0.7997000     -0.4343000    


%chk=000020043-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020043

0 1
O 3.568450 -0.002195 -0.051448
O 1.302924 -3.585456 -0.029531
O 1.439633 3.596707 -0.042988
O 3.375664 -2.642652 -0.027612
O 3.443279 2.518054 -0.053573
N 2.094769 -2.559236 -0.029204
N 2.118696 2.512332 -0.043916
C -0.694396 0.016874 -0.016270
C -2.194903 0.005720 -0.004552
C 0.024181 1.225987 -0.023912
C 0.040731 -1.195548 -0.019319
C 1.448830 -1.216027 -0.029760
C 1.437149 1.219236 -0.035015
C 2.211342 -0.002031 -0.038662
C -2.902314 0.008193 1.225202
C -2.921855 -0.010367 -1.222718
C -4.315631 -0.004063 1.235383
C -4.335174 -0.022573 -1.210171
C -5.035124 -0.019346 0.018318
H -0.493037 2.189487 -0.021719
H -0.476757 -2.159154 -0.013023
H -2.347818 0.018851 2.170488
H -2.382507 -0.013984 -2.176771
H -4.852098 -0.002054 2.190444
H -4.886773 -0.034894 -2.156495
H -6.130474 -0.029186 0.027150
H 3.871811 0.986024 -0.054729


