%chk=000043767.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043767

0 1
 O   -4.169000      0.8144000      0.9302000    
 O   0.2105000      -2.217100      0.7100000    
 N   0.7940000     -0.3126000      3.7000000E-03
 N    1.123500      -1.578700      0.1728000    
 C    1.920800      0.6199000      0.1723000    
 C   0.1471000     -7.5900003E-02  -1.281600    
 C   -1.333100     -0.4465000      -1.207000    
 C    1.380900       2.053000      0.1194000    
 C    2.574900      0.3542000       1.532300    
 C    2.937400      0.3980000     -0.9538000    
 C   -2.059600      0.3907000     -0.1556000    
 C   -3.527500      6.9999998E-04 -4.2800002E-02
 H   0.1613000      0.9563000      -1.637000    
 H   0.6129000     -0.6617000      -2.088300    
 H   -1.470900      -1.515400      -1.009100    
 H   -1.788800     -0.2624000      -2.188500    
 H   0.4647000       2.167400      0.7108000    
 H    2.114400       2.744900      0.5535000    
 H    1.198900       2.434000     -0.8900000    
 H    3.062100     -0.6260000       1.592800    
 H    1.846500      0.4247000       2.349400    
 H    3.355700       1.097400       1.735600    
 H    2.546800      0.6403000      -1.948100    
 H    3.806200       1.051500     -0.8030000    
 H    3.324600     -0.6270000     -0.9824000    
 H   -1.985300       1.457600     -0.4008000    
 H   -1.598600      0.2781000      0.8328000    
 H   -4.043500      0.1461000     -0.9969000    
 H   -3.640400      -1.047400      0.2527000    
 H   -3.719300      0.6656000       1.779400    


%chk=000043767-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043767

0 1
O -4.132330 1.272748 0.853868
O 0.509994 -2.691253 -0.061703
N 0.990499 -0.498005 -0.200634
N 1.191162 -1.709406 0.434719
C 1.945110 0.614733 0.180599
C 0.127744 -0.432521 -1.412368
C -1.390593 -0.588469 -1.141793
C 1.170120 1.949406 0.318869
C 2.623340 0.282388 1.532457
C 3.027544 0.730930 -0.930183
C -2.003306 0.465168 -0.194490
C -3.522200 0.269810 -0.035566
H 0.331082 0.526462 -1.916896
H 0.440612 -1.257695 -2.082955
H -1.572303 -1.604472 -0.748847
H -1.894401 -0.529486 -2.128521
H 0.411101 1.884441 1.116942
H 1.882313 2.750913 0.583967
H 0.666493 2.247162 -0.617363
H 3.252461 -0.618414 1.467003
H 1.876225 0.112543 2.325965
H 3.257134 1.140682 1.820804
H 2.586055 0.979524 -1.912193
H 3.743346 1.531312 -0.670411
H 3.584843 -0.217309 -1.025970
H -1.817804 1.490069 -0.571152
H -1.518526 0.391669 0.801010
H -4.037054 0.417564 -1.000517
H -3.740666 -0.760943 0.319579
H -3.740795 1.174548 1.758580


