%chk=000039683.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039683

0 1
 O   -2.815700     -0.3971000      0.3292000    
 O   -3.397700       1.807100      0.4142000    
 O   0.3569000       2.974500     -0.3776000    
 O   -1.744200       3.472900      5.6100000E-02
 N    1.178400      0.7310000     -0.5237000    
 N  -0.8170000       2.677200     -0.1296000    
 C    2.267500     -0.1829000     -0.3205000    
 C    3.539400      0.5802000      4.5699999E-02
 C  -0.1271000      0.4147000     -0.2494000    
 C    4.707500     -0.3765000      0.2875000    
 C  -0.4946000      -1.022300     -0.1585000    
 C   -1.130400       1.286000     -4.9400002E-02
 C   -1.819000      -1.373000      0.1278000    
 C   0.4112000      -2.080400     -0.3450000    
 C    5.985900      0.3770000      0.6179000    
 C   -2.532200      0.9558000      0.2473000    
 C   -2.243500      -2.701300      0.2309000    
 C   9.9999997E-05  -3.416400     -0.2455000    
 C   -1.325500      -3.726500      4.2500000E-02
 H    2.505700     -0.7005000      -1.255900    
 H    2.126600     -0.8173000      0.5610000    
 H    3.364600       1.187500      0.9433000    
 H    3.794700       1.281100     -0.7595000    
 H    1.410800       1.688100     -0.7556000    
 H    4.876000     -0.9928000     -0.6033000    
 H    4.469000      -1.057500       1.112800    
 H    1.407700      -2.066500     -0.7361000    
 H    6.807300     -0.3260000      0.7879000    
 H    6.272600       1.042200     -0.2029000    
 H    5.862600      0.9807000       1.522700    
 H   -3.280400      -2.936000      0.4529000    
 H   0.7109000      -4.218100     -0.4294000    
 H   -1.641600      -4.762800      0.1102000    


%chk=000039683-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039683

0 1
O -2.822886 -0.368636 0.438265
O -3.445243 1.802031 0.086005
O 0.572946 2.959517 -0.560348
O -1.440324 3.575408 0.288732
N 1.220867 0.501981 -0.454524
N -0.651199 2.655079 -0.126085
C 2.441294 -0.309591 -0.277649
C 3.617253 0.607417 0.123424
C -0.091046 0.195960 -0.268142
C 4.937828 -0.181208 0.273096
C -0.585337 -1.190511 -0.194789
C -1.057540 1.261736 -0.116876
C -1.932603 -1.411073 0.217855
C 0.178669 -2.345410 -0.548842
C 6.121912 0.726909 0.667678
C -2.486716 1.019765 0.107755
C -2.461648 -2.710745 0.386705
C -0.347984 -3.639403 -0.414995
C -1.665052 -3.825595 0.081089
H 2.703288 -0.833959 -1.220072
H 2.278997 -1.075926 0.502614
H 3.376134 1.120140 1.074885
H 3.747226 1.398335 -0.642728
H 1.351151 1.536706 -0.597733
H 5.168767 -0.697010 -0.681323
H 4.809442 -0.974945 1.036901
H 1.178890 -2.234744 -0.966176
H 7.055451 0.145298 0.771165
H 6.293554 1.509519 -0.094509
H 5.930375 1.233442 1.631755
H -3.496599 -2.809472 0.725365
H 0.258871 -4.504049 -0.700407
H -2.072241 -4.834866 0.199911


