%chk=000057854.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057854

0 1
 N    1.796400       1.797200     -6.0300000E-02
 C    1.107700      0.6483000      0.5474000    
 C  -0.3328000      0.5545000     -1.1000000E-02
 C    1.942100     -0.6054000      0.3663000    
 C   -1.243000     -0.4461000      0.7239000    
 C   0.9997000       3.008300      0.1096000    
 C    2.052400       1.539800      -1.474000    
 C   -2.690300     -0.4421000      0.3024000    
 C    2.925500     -0.8979000       1.292800    
 C    1.698500      -1.423700     -0.7209000    
 C   0.7243000       3.290700       1.572000    
 C    2.807800       2.683800      -2.118400    
 C    3.693200      -2.050600       1.126100    
 C    2.466100      -2.576400     -0.8875000    
 C   -3.586600      0.3949000      0.9502000    
 C   -3.102800      -1.275900     -0.7263000    
 C    3.463400      -2.889900      3.5900000E-02
 C   -4.926000      0.3983000      0.5605000    
 C   -4.442100      -1.272400      -1.116200    
 C   -5.353600     -0.4354000     -0.4727000    
 H    1.029800      0.7908000       1.632800    
 H  -0.3780000      0.3372000      -1.082800    
 H  -0.8704000       1.499100      0.1037000    
 H  -0.8502000      -1.464100      0.6097000    
 H   -1.194800     -0.2464000       1.803300    
 H    1.607500       3.863500     -0.2122000    
 H   9.4800003E-02   3.072700     -0.5042000    
 H    2.720700      0.6858000      -1.611300    
 H    1.147800       1.364500      -2.065300    
 H    3.113700     -0.2497000       2.143600    
 H   0.9434000      -1.218100      -1.470000    
 H  -4.8999999E-02   2.644400       1.997400    
 H    1.631100       3.202700       2.181200    
 H   0.3633000       4.319700       1.684000    
 H    2.177300       3.563900      -2.279600    
 H    3.681600       2.978200      -1.526700    
 H    3.172700       2.377100      -3.105500    
 H    4.470300      -2.294300       1.844700    
 H    2.289300      -3.229000      -1.737600    
 H   -3.262700       1.049800       1.754200    
 H   -2.399800      -1.929500      -1.235000    
 H    4.061600      -3.786900     -9.4400004E-02
 H   -5.635600       1.050600       1.061000    
 H   -4.775100      -1.921100      -1.921200    
 H   -6.396400     -0.4326000     -0.7764000    


%chk=000057854-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057854

0 1
N 1.609255 1.862348 -0.066634
C 0.885308 0.656870 0.452470
C -0.567535 0.507164 -0.087782
C 1.773614 -0.588965 0.270478
C -1.468733 -0.386783 0.811795
C 1.166770 3.147073 0.528799
C 1.755049 1.894618 -1.546200
C -2.878050 -0.525868 0.256001
C 3.044669 -0.594582 0.903198
C 1.402487 -1.720441 -0.496633
C 1.630096 3.334500 1.987734
C 3.012094 2.660488 -2.004260
C 3.915820 -1.696823 0.782423
C 2.275563 -2.827443 -0.627946
C -3.843925 0.494210 0.462175
C -3.249050 -1.655094 -0.519279
C 3.533468 -2.822552 0.012722
C -5.138742 0.393612 -0.093657
C -4.542869 -1.760982 -1.079072
C -5.492994 -0.735001 -0.869710
H 0.799128 0.819185 1.547406
H -0.569837 0.114508 -1.122414
H -1.027852 1.513347 -0.143895
H -1.004087 -1.383824 0.923444
H -1.501893 0.064414 1.823992
H 1.604534 3.958598 -0.079966
H 0.056872 3.283754 0.471011
H 1.840542 0.847907 -1.892070
H 0.852499 2.325455 -2.046554
H 3.347871 0.292080 1.471750
H 0.432918 -1.749641 -1.006091
H 1.189430 2.581954 2.666862
H 2.729187 3.248911 2.049759
H 1.330682 4.331747 2.361225
H 2.987507 3.722971 -1.699643
H 3.914827 2.200490 -1.566302
H 3.098332 2.632263 -3.106864
H 4.891382 -1.680479 1.282066
H 1.971173 -3.691004 -1.230729
H -3.579773 1.369854 1.069212
H -2.520334 -2.460258 -0.678712
H 4.208178 -3.680493 -0.086287
H -5.872032 1.189493 0.081115
H -4.811082 -2.643092 -1.672005
H -6.497668 -0.816191 -1.299732


