%chk=000043355.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043355

0 1
 N   0.2779000     -3.5100002E-02 -8.6700000E-02
 N   -1.921900     -0.8935000      0.3240000    
 N  -4.2199999E-02  -2.345700      0.1484000    
 N   -4.464000       2.407200     -0.2451000    
 N   -1.664900      -4.190600     -0.3294000    
 C    1.684700     -0.4098000     -0.3226000    
 C    2.375200     -0.5115000       1.042300    
 C    2.254400      0.5983000      -1.321200    
 C    2.749600      0.8240000       1.692100    
 C    3.671200      0.3225000      -1.816400    
 C    4.230300       1.193700       1.578400    
 C    4.806200      0.3804000     -0.7942000    
 C    4.745900       1.554000      0.1834000    
 C  -0.5510000     -0.9950000      0.1417000    
 C   -2.776100      0.2155000      0.1326000    
 C   -4.013300      0.2560000      0.7622000    
 C   -2.378800       1.265700     -0.6848000    
 C  -0.9168000      -3.331700     -0.1078000    
 C   -4.813800       1.365500      0.5426000    
 C   -3.252400       2.330000     -0.8396000    
 H    1.783100      -1.362600     -0.8545000    
 H    3.254400      -1.159100      0.9676000    
 H    1.713800      -1.034600       1.745500    
 H    2.177500       1.619500     -0.9317000    
 H    1.601300      0.5975000      -2.206100    
 H    2.532700      0.7373000       2.765500    
 H    2.118400       1.643900       1.332900    
 H    3.889900       1.062500      -2.598000    
 H    3.700000     -0.6533000      -2.317000    
 H    4.842200      0.3844000       1.996600    
 H    4.402200       2.063200       2.226500    
 H    5.739300      0.4660000      -1.367900    
 H    4.895500     -0.5723000     -0.2632000    
 H    4.185200       2.398500     -0.2317000    
 H    5.772800       1.920400      0.3172000    
 H   -2.395700      -1.677100      0.7653000    
 H   0.9401000      -2.551000      0.2762000    
 H   -4.353600     -0.5469000       1.407400    
 H   -1.443200       1.279900      -1.229200    
 H   -5.789500       1.447700       1.010200    
 H   -2.995200       3.172400      -1.473300    


%chk=000043355-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043355

0 1
N 0.293192 -0.317397 -0.261697
N -1.959321 -0.993508 0.144919
N -0.278447 -2.652649 0.083234
N -4.203265 2.646721 0.127233
N -2.004074 -4.476651 0.519354
C 1.742556 -0.612668 -0.396780
C 2.413692 -0.529622 1.011255
C 2.295317 0.372508 -1.454471
C 2.596509 0.906985 1.579553
C 3.771376 0.198321 -1.877920
C 4.033954 1.482934 1.478202
C 4.869299 0.499216 -0.816929
C 4.622157 1.756531 0.066890
C -0.593391 -1.234684 -0.026125
C -2.647991 0.239482 0.127535
C -4.056793 0.208949 0.329677
C -2.031184 1.502504 -0.075982
C -1.172681 -3.633935 0.309467
C -4.776104 1.418871 0.320556
C -2.849543 2.652652 -0.065075
H 1.932409 -1.645250 -0.794481
H 3.394632 -1.038565 0.970272
H 1.788993 -1.123602 1.707995
H 2.120288 1.401309 -1.089032
H 1.659127 0.266555 -2.354956
H 2.325385 0.897178 2.653339
H 1.871914 1.592204 1.098346
H 3.933783 0.883375 -2.734606
H 3.926638 -0.825960 -2.277500
H 4.723542 0.793642 2.010606
H 4.056146 2.435688 2.046280
H 5.823201 0.624392 -1.366555
H 5.024828 -0.377669 -0.159124
H 3.978618 2.478706 -0.475452
H 5.589231 2.275741 0.219589
H -2.547400 -1.816510 0.307010
H 0.703622 -2.898354 -0.055568
H -4.584329 -0.738920 0.491590
H -0.954781 1.562117 -0.236993
H -5.861111 1.415705 0.474278
H -2.398591 3.639858 -0.219733


