%chk=000005519.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005519

0 1
 N    1.790100     -0.7186000      0.5459000    
 N   -1.777400     -0.7095000     -0.5530000    
 N    3.788100      -1.147900      -1.419600    
 N    2.631800       1.984200      0.7090000    
 N   -3.765700      -1.186100       1.412400    
 N   -2.660500       1.981900     -0.6938000    
 C   0.3342000     -0.7221000      0.6845000    
 C  -0.3253000     -0.6881000     -0.6910000    
 C    2.278900      -2.065500      0.2535000    
 C    2.417900     -0.1994000       1.760400    
 C   -2.247700      -2.067000     -0.2724000    
 C   -2.417200     -0.1901000      -1.762800    
 C    3.627000      -2.039900     -0.4167000    
 C    2.334000       1.301900       1.837400    
 C   -3.594500      -2.066000      0.4006000    
 C   -2.356000       1.312900      -1.828300    
 C    4.615500      -2.909800      1.4200000E-02
 C    1.964900       1.900500       3.031300    
 C   -4.572200      -2.945200     -3.6600001E-02
 C   -1.999600       1.926100      -3.018700    
 C    5.849200      -2.860900     -0.6253000    
 C    1.896800       3.288800       3.069300    
 C   -5.805000      -2.919200      0.6058000    
 C   -1.952300       3.315500      -3.046100    
 C    5.000400      -1.129400      -2.017700    
 C    2.554800       3.331800      0.7841000    
 C   -4.976900      -1.189700       2.013000    
 C   -2.603900       3.331000     -0.7587000    
 C    6.053400      -1.956500      -1.661600    
 C    2.195800       4.025500       1.928500    
 C   -6.019400      -2.027700       1.651100    
 C   -2.258800       4.038800      -1.898800    
 H   1.4400000E-02  -1.573200       1.297000    
 H  -8.6000003E-03  0.1741000       1.219500    
 H   6.6000000E-03  0.2386000      -1.178500    
 H   8.8000000E-03  -1.505400      -1.341500    
 H    2.298400      -2.679000       1.164700    
 H    1.621200      -2.595300     -0.4459000    
 H    1.990100     -0.6710000       2.655500    
 H    3.491600     -0.4284000       1.778500    
 H   -2.262600      -2.669300      -1.191300    
 H   -1.584600      -2.601200      0.4175000    
 H   -1.984100     -0.6481000      -2.662400    
 H   -3.487300     -0.4352000      -1.779800    
 H    4.448400      -3.613000      0.8230000    
 H    1.733500       1.319000       3.917200    
 H   -4.397200      -3.638300     -0.8523000    
 H   -1.762400       1.354900      -3.909700    
 H    6.649900      -3.526300     -0.3169000    
 H    1.611200       3.795800       3.986100    
 H   -6.597300      -3.592500      0.2926000    
 H   -1.677100       3.833700      -3.959800    
 H    5.108500     -0.4064000      -2.819300    
 H    2.796700       3.859600     -0.1325000    
 H   -5.093000     -0.4759000       2.821800    
 H   -2.851000       3.847900      0.1626000    
 H    7.006800      -1.900900      -2.174300    
 H    2.149000       5.108300       1.934900    
 H   -6.972300      -1.989800       2.166200    
 H   -2.228100       5.122300      -1.896900    


%chk=000005519-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005519

0 1
N 1.759645 -0.892849 0.721493
N -1.753065 -0.900687 -0.731472
N 3.410308 -2.117332 -1.690774
N 3.056732 2.024624 0.809372
N -3.389414 -2.170221 1.668080
N -3.076587 2.007258 -0.790328
C 0.279944 -0.850730 0.717511
C -0.273765 -0.845562 -0.726841
C 2.330938 -2.245009 0.513307
C 2.427354 -0.136229 1.804593
C -2.312346 -2.260236 -0.538929
C -2.427291 -0.138082 -1.806405
C 3.594997 -2.214925 -0.335202
C 2.232182 1.368928 1.687653
C -3.575364 -2.251398 0.311602
C -2.244903 1.367345 -1.673476
C 4.886346 -2.279039 0.244729
C 1.256489 2.053969 2.455405
C -4.867062 -2.317926 -0.267307
C -1.273310 2.068161 -2.432185
C 6.025649 -2.214724 -0.589387
C 1.107742 3.451119 2.303047
C -6.005566 -2.273215 0.569169
C -1.136306 3.464842 -2.265323
C 4.516471 -2.062244 -2.483867
C 2.905295 3.372453 0.674997
C -4.494775 -2.133998 2.463377
C -2.936559 3.354880 -0.642046
C 5.840534 -2.099382 -1.984521
C 1.947009 4.128574 1.391210
C -5.819247 -2.174683 1.965432
C -1.983059 4.126070 -1.348518
H -0.171421 -1.687829 1.301856
H -0.062616 0.078911 1.201463
H 0.060743 0.092038 -1.200908
H 0.184967 -1.672425 -1.319990
H 2.543990 -2.759286 1.483369
H 1.583264 -2.851600 -0.025456
H 2.094377 -0.474543 2.819716
H 3.512029 -0.328775 1.723621
H -2.522291 -2.764318 -1.514975
H -1.558751 -2.866937 -0.008604
H -2.091432 -0.462667 -2.825051
H -3.510283 -0.340686 -1.727549
H 4.991808 -2.383176 1.330387
H 0.627372 1.497357 3.158367
H -4.973391 -2.408702 -1.354076
H -0.638169 1.523979 -3.139462
H 7.032804 -2.254959 -0.160505
H 0.353977 3.995446 2.881976
H -7.013024 -2.315582 0.141209
H -0.385810 4.021192 -2.837014
H 4.328137 -1.990024 -3.561939
H 3.587383 3.859582 -0.032532
H -4.305388 -2.074520 3.542042
H -3.624032 3.829197 0.068967
H 6.691907 -2.046354 -2.670708
H 1.871001 5.210429 1.240818
H -6.669972 -2.137129 2.653443
H -1.916297 5.206926 -1.186960


