%chk=000028148.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028148

0 1
 O    2.590300      0.7733000       1.831300    
 O   -6.208900      0.2070000     -0.9013000    
 O   -5.926900       2.198700      0.2178000    
 N    3.512800     -0.4488000      2.0800000E-02
 N    3.220900      -1.609000     -0.6637000    
 N   0.3377000     -0.7805000      0.6545000    
 N  -0.5494000      -1.079300       1.487500    
 C    1.636600      -1.314000       1.024500    
 C    2.164500      -2.118900     -0.1142000    
 C    2.613000     -0.1750000       1.064600    
 C    4.601900      0.3155000     -0.3663000    
 C    1.530100      -3.391900     -0.5570000    
 C    4.905700       1.505000      0.3063000    
 C    5.409900     -9.3800001E-02  -1.433500    
 C    6.002000       2.274400     -8.2900003E-02
 C    6.506400      0.6756000      -1.822500    
 C   -1.785900     -0.5428000       1.091000    
 C    6.802400       1.859700      -1.147200    
 C   -4.234500      0.5215000      0.3044000    
 C   -2.153900      0.7311000       1.513900    
 C   -2.633900      -1.288200      0.2772000    
 C   -3.381000       1.264300       1.119800    
 C   -3.861200     -0.7548000     -0.1169000    
 C   -5.513900       1.077500     -0.1067000    
 C   -7.488600      0.6423000      -1.373100    
 C   -8.096200     -0.4490000      -2.228400    
 H    1.667000      -1.888700       1.955800    
 H    1.465000      -4.078600      0.2910000    
 H    2.121300      -3.855700      -1.350800    
 H   0.5239000      -3.188600     -0.9321000    
 H    4.335400       1.892400       1.139300    
 H    5.213600      -1.009700      -1.984900    
 H    6.233800       3.196600      0.4422000    
 H    7.130100      0.3532000      -2.651200    
 H    7.656200       2.458800      -1.450200    
 H   -1.494900       1.316400       2.149600    
 H   -2.350200      -2.283300     -5.5000000E-02
 H   -3.652600       2.260400       1.459300    
 H   -4.493200      -1.369200     -0.7519000    
 H   -8.140100      0.8500000     -0.5172000    
 H   -7.366000       1.554900      -1.966800    
 H   -9.077400     -0.1491000      -2.606600    
 H   -7.445000     -0.6801000      -3.077900    
 H   -8.206600      -1.373500      -1.652000    


%chk=000028148-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028148

0 1
O 2.328397 0.483283 1.755726
O -6.816130 0.202390 -0.396449
O -5.979519 1.637469 -2.032497
N 3.791604 -0.379081 0.065671
N 3.741292 -1.396052 -0.950133
N 0.422269 -0.833585 -0.314832
N -0.608433 -1.226783 0.375693
C 1.680857 -1.409804 0.218985
C 2.558892 -1.974956 -0.888163
C 2.597894 -0.294754 0.809355
C 4.993327 0.385967 0.196902
C 2.145997 -3.058147 -1.832399
C 5.086686 1.426467 1.159078
C 6.094362 0.090844 -0.648605
C 6.286705 2.161661 1.262877
C 7.283261 0.838249 -0.527959
C -1.866255 -0.677697 -0.061292
C 7.389578 1.876889 0.426172
C -4.442973 0.252349 -0.736663
C -2.015393 0.303325 -1.082109
C -3.003193 -1.179846 0.621919
C -3.299268 0.761057 -1.413521
C -4.289969 -0.720177 0.284657
C -5.782437 0.779199 -1.135752
C -8.196203 0.670789 -0.731098
C -9.153230 -0.087428 0.182044
H 1.466248 -2.156359 1.012530
H 1.879060 -3.983105 -1.287212
H 2.958837 -3.283346 -2.540764
H 1.248831 -2.747795 -2.400515
H 4.237631 1.648975 1.808384
H 6.003144 -0.711337 -1.383832
H 6.354507 2.963688 2.006212
H 8.129530 0.606389 -1.184083
H 8.315999 2.454160 0.515366
H -1.123443 0.686480 -1.586059
H -2.849570 -1.924434 1.409302
H -3.450258 1.516300 -2.191651
H -5.175929 -1.098809 0.800268
H -8.236450 1.764198 -0.576257
H -8.378862 0.469099 -1.802119
H -10.192651 0.224338 -0.027487
H -9.078309 -1.175896 0.017402
H -8.936234 0.121921 1.243407


