%chk=000168629.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168629

0 1
 O  -0.9467000     -0.9974000       1.134200    
 O   -2.929600     -0.5310000      -1.827500    
 O   -2.064600      -3.586600       1.247800    
 O    1.561200       2.247400      0.9953000    
 O    4.823500     -0.5178000     -0.7239000    
 N   0.9485000      9.3800001E-02  0.3290000    
 N   -2.419200       1.493900     -6.6000000E-03
 N    3.184200      0.8692000      0.1382000    
 N   -2.260000       2.725400     -4.4000000E-03
 N   -2.125200       3.858000      2.2000000E-03
 C   -1.279800      0.7077000     -0.4997000    
 C   -1.756500     -0.6228000      -1.047600    
 C  -0.4331000      0.2713000      0.6884000    
 C   -1.969400      -1.431100      0.2216000    
 C   -1.861800      -2.930400      6.8999999E-03
 C    1.866500       1.150100      0.5234000    
 C    1.372900      -1.114700     -0.2072000    
 C    2.632300      -1.367700     -0.5695000    
 C    3.656700     -0.3175000     -0.4006000    
 H  -0.7259000       1.277100      -1.256900    
 H  -0.9807000      -1.072500      -1.676300    
 H  -0.4993000      0.9742000       1.526600    
 H   -2.937100      -1.202900      0.6864000    
 H  -0.8940000      -3.251700     -0.3814000    
 H   -2.634200      -3.275800     -0.6873000    
 H   -2.752000      9.6400000E-02  -2.548800    
 H   0.6537000      -1.902400     -0.3408000    
 H   -1.377400      -3.272300       1.860100    
 H    3.863300       1.613900      0.2682000    
 H    2.929700      -2.323000     -0.9841000    


%chk=000168629-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168629

0 1
O -0.849230 -1.250585 0.884769
O -3.112967 -0.349308 -1.903844
O -2.462421 -3.702737 1.141217
O 1.197331 2.300620 0.294423
O 5.172380 -0.059593 -0.504049
N 1.122530 -0.040342 0.253269
N -2.253214 1.539778 -0.209309
N 3.172453 1.082034 -0.093227
N -1.971570 2.745173 0.077854
N -1.903260 3.885528 0.379749
C -1.157788 0.620334 -0.642648
C -1.892359 -0.643594 -1.189629
C -0.335263 0.075807 0.573220
C -2.102645 -1.489004 0.089431
C -2.232821 -2.993388 -0.117617
C 1.806314 1.198647 0.161880
C 1.778810 -1.260944 0.110267
C 3.125472 -1.337363 -0.147876
C 3.934411 -0.125278 -0.271921
H -0.506212 1.104437 -1.388960
H -1.238241 -1.178540 -1.901364
H -0.429658 0.749419 1.443704
H -2.962558 -1.103158 0.671016
H -1.330109 -3.376298 -0.642716
H -3.120888 -3.197724 -0.738524
H -3.541420 0.424911 -1.442499
H 1.142696 -2.138484 0.236902
H -1.722175 -3.483737 1.763337
H 3.691713 1.963668 -0.165374
H 3.626692 -2.299478 -0.255781


