%chk=000016434.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016434

0 1
 O    1.445600     -0.3495000       2.563100    
 N   -3.694300     -0.6758000     -0.1154000    
 C   -5.595700     -0.1189000      -1.351400    
 C   -4.586400       1.021100      -1.447400    
 C   -5.125700     -0.9693000     -0.1804000    
 C   -3.593000      0.7684000     -0.3230000    
 C   0.9444000     -0.2313000       1.236900    
 C    1.753200      -1.144100      0.3250000    
 C    1.258600       1.141900      0.6529000    
 C   -3.096700      -1.099600       1.142100    
 C    2.435200     -0.3840000     -0.6530000    
 C    2.132100       1.016900     -0.4521000    
 C  -0.4901000     -0.5382000       1.201000    
 C    1.875600      -2.524800      0.3739000    
 C   0.8094000       2.384700       1.073800    
 C    3.239900      -1.004900      -1.594900    
 C    2.558700       2.138100      -1.145600    
 C   -1.664100     -0.7901000       1.171400    
 C    2.686500      -3.149200     -0.5755000    
 C    1.239800       3.513700      0.3745000    
 C    3.361200      -2.396800      -1.550900    
 C    2.105500       3.391500     -0.7247000    
 H   -6.613300      0.2528000      -1.194400    
 H   -5.589400     -0.6989000      -2.281700    
 H   -4.086800      0.9921000      -2.423000    
 H   -5.068200       1.998900      -1.345700    
 H   -5.647000     -0.6590000      0.7343000    
 H   -5.322200      -2.032500     -0.3501000    
 H   -2.588500       1.090300     -0.6164000    
 H   -3.895900       1.332100      0.5691000    
 H   -3.591800     -0.6284000       2.000700    
 H   -3.222000      -2.183100       1.256700    
 H    1.358000      -3.111200       1.125200    
 H   0.1423000       2.484400       1.923100    
 H    3.770100     -0.4375000      -2.352700    
 H    3.228700       2.060400      -1.995400    
 H    1.380000      -1.280200       2.837600    
 H    2.798500      -4.230100     -0.5609000    
 H   0.9022000       4.499500      0.6832000    
 H    3.987300      -2.904900      -2.279700    
 H    2.427400       4.284800      -1.253700    


%chk=000016434-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016434

0 1
O 1.467020 -0.261996 2.558384
N -3.819943 -0.651226 -0.081549
C -5.831850 -0.191828 -1.294256
C -4.791649 0.959560 -1.523208
C -5.262734 -1.009875 -0.102462
C -3.778004 0.807118 -0.363419
C 0.967343 -0.227032 1.146887
C 1.796897 -1.156049 0.236930
C 1.335023 1.161282 0.602405
C -3.129134 -1.077559 1.154889
C 2.593426 -0.386358 -0.657808
C 2.299034 1.046908 -0.438130
C -0.477454 -0.524725 1.126426
C 1.850984 -2.556639 0.234892
C 0.865567 2.409908 1.028258
C 3.467268 -1.026832 -1.559685
C 2.802164 2.203992 -1.067482
C -1.683798 -0.783950 1.135076
C 2.733880 -3.202528 -0.669020
C 1.373335 3.575053 0.397479
C 3.534679 -2.441806 -1.555520
C 2.331514 3.469906 -0.640682
H -6.838523 0.197040 -1.061392
H -5.916109 -0.819508 -2.197267
H -4.278856 0.822973 -2.490161
H -5.259411 1.959360 -1.524755
H -5.774237 -0.706827 0.848897
H -5.390782 -2.100742 -0.223275
H -2.754639 1.122328 -0.627334
H -4.107003 1.406038 0.526053
H -3.577827 -0.594976 2.066095
H -3.277828 -2.169638 1.269880
H 1.215265 -3.148443 0.903758
H 0.130269 2.481704 1.836000
H 4.083087 -0.447833 -2.256907
H 3.542521 2.133435 -1.872056
H 1.191957 -1.132577 2.950594
H 2.791976 -4.296400 -0.687127
H 1.024111 4.563517 0.715760
H 4.209134 -2.955096 -2.250115
H 2.712427 4.379621 -1.118552


