%chk=000126704.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126704

0 1
 O    2.246700      -1.463400      -1.756500    
 O    4.259000     -0.6234000     -8.9400001E-02
 O    2.152000       2.303800      0.3323000    
 N  -9.4400004E-02 -0.9456000      0.3558000    
 N   -2.104800      -1.900200      0.4488000    
 N  -0.7343000       1.324200     -0.2244000    
 N   -3.156700       1.534200     -0.4337000    
 N   -4.640600     -0.3120000     -9.2000000E-02
 C    1.360400     -0.8138000      0.4209000    
 C    1.994600     -0.3601000     -0.9045000    
 C    1.861500      0.1916000       1.485100    
 C    3.282700      0.3392000     -0.4708000    
 C    2.833900       1.129000      0.7543000    
 C  -0.9922000      3.9600000E-02  6.3199997E-02
 C  -0.8086000      -2.091600      0.5792000    
 C   -2.233800     -0.5726000      0.1264000    
 C   -3.342700      0.2257000     -0.1355000    
 C   -1.882900       1.995300     -0.4592000    
 H    1.732800      -1.813500      0.6852000    
 H    1.355700      0.3353000      -1.456800    
 H    1.052700      0.7406000       1.978300    
 H    2.403900     -0.3667000       2.258000    
 H    3.689800      0.9585000      -1.276100    
 H    3.663700       1.423900       1.403500    
 H    2.880600      -2.049100      -1.308600    
 H  -0.3369000      -3.031400      0.8322000    
 H    5.035800     -0.1364000      0.2344000    
 H    1.320800       2.050100     -0.1009000    
 H   -1.771000       3.046900     -0.7011000    
 H   -4.782000      -1.288100      0.1303000    
 H   -5.430400      0.2884000     -0.2861000    


%chk=000126704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126704

0 1
O 2.533723 -1.778527 -1.579521
O 4.327753 -0.480618 -0.171117
O 1.823317 2.296948 0.250792
N -0.080211 -1.025484 0.430009
N -2.194434 -1.937950 0.403993
N -0.681918 1.339317 -0.097175
N -3.094438 1.645611 -0.388464
N -4.640775 -0.127214 -0.185081
C 1.393622 -0.950244 0.518873
C 2.050812 -0.604833 -0.873117
C 1.912116 0.121321 1.531573
C 3.184593 0.395647 -0.531002
C 2.662400 1.197163 0.690201
C -0.958315 0.019824 0.139475
C -0.879380 -2.172720 0.571720
C -2.255962 -0.560136 0.132336
C -3.348545 0.312636 -0.147158
C -1.803807 2.080026 -0.350673
H 1.729914 -1.961388 0.803455
H 1.307864 -0.124966 -1.531596
H 1.102731 0.577090 2.125633
H 2.618928 -0.360886 2.227911
H 3.440119 1.064103 -1.372921
H 3.495236 1.653764 1.256054
H 3.472049 -1.912021 -1.264845
H -0.442170 -3.144824 0.789707
H 5.154608 0.054649 -0.106000
H 0.862831 1.970308 0.072741
H -1.646536 3.144256 -0.546418
H -4.846982 -1.109419 -0.013618
H -5.383846 0.536966 -0.393469


