%chk=000030912.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030912

1 1
 O    3.698600      -1.256700     -4.0000002E-03
 N   -2.855100     -1.8200001E-02 -1.3000000E-03
 N    4.511000      0.8934000     -3.1999999E-03
 C   -1.557500     -0.7331000      3.4000000E-03
 C  -0.3966000      0.2547000      8.7000001E-03
 C   -4.026800      -1.009500      5.8200002E-02
 C   -2.966400      0.9220000       1.208000    
 C   -3.011100      0.8255000      -1.275100    
 C   0.9791000     -0.4232000      4.4999998E-03
 C    2.123500      0.5904000     -3.7000000E-03
 C    3.501300     -4.5200001E-02  4.4999998E-03
 H   -1.518200      -1.378900     -0.8820000    
 H   -1.522700      -1.371600      0.8945000    
 H  -0.4257000      0.8934000      0.8971000    
 H  -0.4309000      0.9097000     -0.8671000    
 H   -3.960300      -1.665500     -0.8146000    
 H   -3.936000      -1.587500      0.9825000    
 H   -4.965400     -0.4477000      4.6599999E-02
 H   -4.000500       1.276600       1.267700    
 H   -2.709700      0.3580000       2.109300    
 H   -2.308100       1.783400       1.071500    
 H   -2.809900      0.1859000      -2.139200    
 H   -4.040000       1.197300      -1.312000    
 H   -2.328300       1.677500      -1.243300    
 H    1.062300      -1.075400     -0.8738000    
 H    1.069500      -1.071500      0.8851000    
 H    2.048900       1.225200     -0.8950000    
 H    2.047000       1.241300      0.8757000    
 H    4.324500       1.891100     -3.3000000E-03
 H    5.485600      0.6113000     -6.0000001E-03


%chk=000030912-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030912

1 1
O 3.526033 -1.386820 -0.007479
N -2.940560 0.019082 0.002869
N 4.685609 0.622680 -0.003824
C -1.488407 -0.538636 0.015109
C -0.354761 0.498618 -0.003002
C -3.902039 -1.170152 0.051011
C -3.188347 0.906370 1.220385
C -3.202206 0.815556 -1.273326
C 0.999507 -0.256369 0.001120
C 2.211438 0.695157 -0.007231
C 3.522861 -0.120832 -0.006275
H -1.416728 -1.200928 -0.866508
H -1.418454 -1.165855 0.922127
H -0.402757 1.159011 0.883595
H -0.408975 1.137012 -0.905361
H -3.715822 -1.818290 -0.818609
H -3.728935 -1.735196 0.979346
H -4.938357 -0.800114 0.026364
H -4.248521 1.202475 1.235563
H -2.944896 0.340078 2.132294
H -2.555367 1.802275 1.157285
H -2.999771 0.173415 -2.144092
H -4.254800 1.137759 -1.282924
H -2.545868 1.696327 -1.298430
H 1.069258 -0.926084 -0.875932
H 1.071191 -0.912806 0.888102
H 2.190671 1.349270 -0.901711
H 2.194640 1.360145 0.879186
H 4.688081 1.641493 -0.001995
H 5.578380 0.128058 -0.003959


