%chk=000099764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099764

0 1
 O   0.6894000      0.3822000      0.5483000    
 N   -1.048600       1.048300     -0.9150000    
 C  -0.9528000      -1.295600     -0.2357000    
 C  -6.3199997E-02 -2.2399999E-02 -0.6252000    
 C   -2.221600     -0.6010000      0.2192000    
 C   -2.219400      0.7268000     -0.2288000    
 C  -0.3325000      -2.160200      0.8719000    
 C   -1.322400      -2.199800      -1.430500    
 C   0.7761000     -0.2416000      -1.867100    
 C  -0.6671000       2.423900      -1.160700    
 C   -3.293600      -1.126300      0.9300000    
 C   -3.312500       1.543800      3.1599998E-02
 C    2.050100      0.2646000      0.5455000    
 C    2.110600     -0.2614000      -1.857100    
 C    2.792000     -5.2200001E-02 -0.5926000    
 C   -4.383900     -0.3002000       1.198100    
 C   -4.394100       1.026300      0.7502000    
 C    2.695100      0.4975000       1.762700    
 C    4.186000     -0.1412000     -0.5047000    
 C    4.083500      0.4043000       1.846400    
 C    4.828700      8.4299996E-02  0.7135000    
 H  -0.2080000      -1.605600       1.808600    
 H  -0.9633000      -3.026600       1.103200    
 H   0.6470000      -2.542900      0.5652000    
 H  -0.4412000      -2.718300      -1.824400    
 H   -2.044000      -2.971700      -1.135800    
 H   -1.781300      -1.633300      -2.249400    
 H   0.2673000     -0.3855000      -2.817400    
 H   0.2547000       2.479900      -1.748000    
 H  -0.4980000       2.956600     -0.2187000    
 H   -1.440700       2.949600      -1.730200    
 H   -3.296500      -2.158000       1.265000    
 H   -3.343400       2.574800     -0.3060000    
 H    2.682600     -0.4241000      -2.762600    
 H   -5.234000     -0.6886000       1.751900    
 H   -5.252100       1.658600      0.9620000    
 H    2.120800      0.7493000       2.650500    
 H    4.784400     -0.3839000      -1.379700    
 H    4.583900      0.5826000       2.793700    
 H    5.910500      1.3400000E-02  0.7773000    


%chk=000099764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099764

0 1
O 0.731652 -0.253807 0.656284
N -0.877945 0.799490 -0.832007
C -1.154050 -1.532714 -0.340958
C -0.068193 -0.409215 -0.655499
C -2.287420 -0.689519 0.252877
C -2.088289 0.668809 -0.111412
C -0.621893 -2.641415 0.587819
C -1.671934 -2.165028 -1.668764
C 0.863703 -0.666651 -1.813507
C -0.282544 2.104376 -1.125227
C -3.426866 -1.066479 0.973506
C -3.018506 1.668751 0.235019
C 2.064990 0.150089 0.634243
C 2.206381 -0.421015 -1.764461
C 2.854109 0.064809 -0.550948
C -4.377620 -0.071963 1.336157
C -4.170897 1.276061 0.964379
C 2.631624 0.593874 1.850923
C 4.223124 0.435916 -0.487838
C 3.994175 0.958147 1.888136
C 4.795594 0.882843 0.719407
H -0.320198 -2.235400 1.564957
H -1.407205 -3.403910 0.746292
H 0.252507 -3.144189 0.135995
H -0.894761 -2.791839 -2.143254
H -2.540276 -2.809502 -1.446717
H -2.000078 -1.391084 -2.385644
H 0.393667 -1.009386 -2.739376
H 0.614487 1.962523 -1.749191
H 0.008368 2.648305 -0.202914
H -0.997100 2.729355 -1.690952
H -3.586649 -2.111823 1.263341
H -2.861058 2.718410 -0.033266
H 2.825250 -0.584720 -2.655454
H -5.269845 -0.350651 1.907040
H -4.907492 2.035895 1.250195
H 2.000735 0.641555 2.743807
H 4.833212 0.368520 -1.397274
H 4.433731 1.301334 2.831340
H 5.852011 1.167649 0.758143


