%chk=000141244.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141244

0 1
 O   3.0000001E-04  -3.627000     -3.9999999E-04
 N   -3.266600     -5.5000000E-02 -0.7406000    
 N    3.267600     -5.5500001E-02  0.7403000    
 N   -4.536600     -0.6523000      0.9828000    
 N    4.537500     -0.6527000     -0.9832000    
 N   -5.923000       1.553800       2.020800    
 N    5.924200       1.553400      -2.020800    
 C   -2.643400      -1.143700     -0.1866000    
 C    2.644300      -1.144100      0.1862000    
 C   -3.455400      -1.497900      0.8872000    
 C    3.456200      -1.498200     -0.8877000    
 C   -4.392100      0.1996000     -7.3000002E-03
 C    4.393000      0.1991000      7.1000000E-03
 C   -1.147900      -2.910100      0.2856000    
 C    1.132500      -2.920200     -0.2823000    
 C   -1.474900      -1.828100     -0.5224000    
 C    1.475700      -1.828300      0.5218000    
 C   -5.281800       1.289300     -0.3266000    
 C    5.282900       1.288600      0.3265000    
 C   -3.095700      -2.597700       1.684200    
 C    3.096300      -2.597900      -1.684800    
 C   -1.926400      -3.299800       1.365700    
 C    1.927000      -3.299900      -1.366500    
 C   -6.020700       1.939900      0.6642000    
 C    6.021900       1.939200     -0.6641000    
 C   -5.399200       1.695000      -1.657700    
 C    5.400400       1.694000       1.657700    
 C   -6.873200       2.990600      0.3252000    
 C    6.874500       2.989800     -0.3250000    
 C   -6.251600       2.745800      -1.996700    
 C    6.252900       2.744600       1.996900    
 C   -6.988600       3.393400      -1.005300    
 C    6.990000       3.392400       1.005600    
 H   -2.930800      0.4668000      -1.539400    
 H    2.931800      0.4662000       1.539200    
 H  -0.8879000      -1.527500      -1.382600    
 H   0.8901000      -1.525300       1.382900    
 H   -3.706200      -2.900500       2.528800    
 H    3.706900      -2.900500      -2.529400    
 H   -1.635800      -4.152400       1.973900    
 H    1.639400      -4.152300      -1.977400    
 H   -4.853600       1.204800      -2.460200    
 H    4.854700       1.203700       2.460200    
 H   -7.453600       3.504600       1.087200    
 H    7.454900       3.503800      -1.086900    
 H   -6.344600       3.057600      -3.033000    
 H    6.346000       3.056200       3.033200    
 H   -7.652900       4.211000      -1.269600    
 H    7.654500       4.209800       1.270000    
 H   -5.306700      0.8060000       2.306600    
 H   -6.467900       2.041600       2.719800    
 H    6.469300       2.041300      -2.719700    
 H    5.307900      0.8058000      -2.306900    


%chk=000141244-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141244

0 1
O 0.000304 -3.302012 0.002333
N -3.486517 0.273283 -0.518846
N 3.488471 0.271981 0.521243
N -4.900108 -0.741292 0.949892
N 4.899012 -0.740657 -0.951758
N -7.292664 0.326728 1.463440
N 7.291068 0.327454 -1.467915
C -2.813903 -0.871382 -0.074577
C 2.814793 -0.871923 0.076600
C -3.719750 -1.498504 0.848005
C 3.718735 -1.497831 -0.848696
C -4.744572 0.324945 0.116103
C 4.745305 0.324345 -0.116049
C -1.204289 -2.603815 0.278750
C 1.204238 -2.603681 -0.276025
C -1.548235 -1.403605 -0.384183
C 1.549716 -1.404474 0.387948
C -5.724129 1.383228 -0.103430
C 5.725477 1.382126 0.103153
C -3.347005 -2.704282 1.483283
C 3.344563 -2.702620 -1.484994
C -2.081277 -3.249477 1.194437
C 2.079313 -3.248056 -1.194418
C -6.994252 1.350596 0.589845
C 6.994339 1.350229 -0.592470
C -5.459191 2.462723 -0.995156
C 5.462341 2.460453 0.996829
C -7.930469 2.405094 0.348145
C 7.931144 2.404277 -0.351083
C -6.389804 3.490026 -1.219840
C 6.393516 3.487314 1.221185
C -7.635385 3.451818 -0.536949
C 7.637834 3.449852 0.535952
H -3.136129 0.947988 -1.194007
H 3.139532 0.945726 1.198110
H -0.865626 -0.938656 -1.100961
H 0.868563 -0.940539 1.106775
H -4.027308 -3.196307 2.184132
H 4.023398 -3.193726 -2.187909
H -1.744581 -4.180583 1.658562
H 1.741597 -4.178441 -1.659253
H -4.501870 2.506180 -1.530540
H 4.506003 2.503348 1.534014
H -8.893842 2.382184 0.872075
H 8.893557 2.381924 -0.876797
H -6.159133 4.306704 -1.910522
H 6.164232 4.303098 1.913383
H -8.373635 4.244986 -0.701188
H 8.376495 4.242695 0.699904
H -6.571467 -0.408563 1.597172
H -8.188551 0.308200 1.944016
H 8.186091 0.309450 -1.950120
H 6.569655 -0.407730 -1.601102


