%chk=000103358.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103358

0 1
 O   -1.585700      0.6222000      -1.425800    
 N   -2.514900       1.455900      0.5318000    
 N   -5.958900      0.1797000     -3.5500001E-02
 N   -8.743800      -2.292900      0.1058000    
 C    3.551600      6.8599999E-02 -0.3796000    
 C    4.841400     -8.8999998E-03  0.4418000    
 C    2.356700      0.6037000      0.4176000    
 C    6.052800     -0.4757000     -0.3724000    
 C    1.047600      0.6118000     -0.3792000    
 C    7.358700     -0.4839000      0.4255000    
 C  -0.1400000       1.078100      0.4633000    
 C    8.528400     -0.9668000     -0.4336000    
 C   -1.469400       1.024300     -0.2714000    
 C    9.836500     -0.9408000      0.3411000    
 C   -3.887500       1.478400      8.2500003E-02
 C   -4.567600      0.1505000      0.4023000    
 C   -6.625600      -1.077500      0.2717000    
 C   -8.080300      -1.026800     -0.1859000    
 H    3.714300      0.7131000      -1.252100    
 H    3.312900     -0.9307000     -0.7637000    
 H    4.691800     -0.6886000       1.289700    
 H    5.055600      0.9810000      0.8635000    
 H    2.577800       1.621400      0.7617000    
 H    2.225200     -1.3000000E-02   1.315400    
 H    5.855500      -1.483500     -0.7582000    
 H    6.170400      0.1793000      -1.244800    
 H   0.8492000     -0.3980000     -0.7597000    
 H    1.154500       1.261100      -1.256800    
 H    7.565300      0.5270000      0.7972000    
 H    7.249900      -1.135000       1.301100    
 H  -0.2266000      0.4500000       1.358400    
 H   2.6200000E-02   2.110200      0.7950000    
 H    8.625800     -0.3316000      -1.321700    
 H    8.336600      -1.987600     -0.7838000    
 H   -3.910200       1.680300     -0.9944000    
 H   -4.384600       2.306400      0.5993000    
 H    10.07400      7.4000001E-02  0.6761000    
 H    10.65840      -1.290900     -0.2911000    
 H    9.784100      -1.590000       1.220900    
 H   -2.320800       1.759300       1.481800    
 H   -4.514400     -2.9600000E-02   1.483500    
 H   -4.028800     -0.6673000     -9.2799999E-02
 H   -6.000900      0.3581000      -1.038600    
 H   -6.592500      -1.265200       1.352300    
 H   -6.111100      -1.907800     -0.2286000    
 H   -8.613200     -0.2188000      0.3278000    
 H   -8.138100     -0.8320000      -1.263100    
 H   -9.698700      -2.263300     -0.2490000    
 H   -8.276900      -3.048600     -0.3940000    


%chk=000103358-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103358

0 1
O -1.667034 1.722997 -1.005003
N -2.528823 1.500493 1.142098
N -5.794354 -0.023410 -0.029300
N -8.505624 -2.560164 -0.728413
C 3.382636 0.052058 -0.092168
C 4.846280 0.260403 0.357071
C 2.381429 0.988378 0.621535
C 5.843481 -0.680760 -0.355987
C 0.926975 0.786122 0.144881
C 7.309324 -0.471979 0.086054
C -0.077983 1.711156 0.871938
C 8.304660 -1.414765 -0.628419
C -1.476262 1.640650 0.248415
C 9.767021 -1.199710 -0.181976
C -3.928157 1.426837 0.694163
C -4.408460 -0.027498 0.479025
C -6.434176 -1.353436 -0.115070
C -7.895276 -1.225383 -0.588365
H 3.309669 0.209353 -1.188430
H 3.090364 -1.003541 0.089407
H 4.919368 0.107612 1.454508
H 5.140380 1.314626 0.170356
H 2.679683 2.043824 0.447729
H 2.444454 0.823484 1.718120
H 5.550735 -1.735070 -0.166976
H 5.767188 -0.530212 -1.453350
H 0.629909 -0.271812 0.294582
H 0.849971 0.984150 -0.940816
H 7.604223 0.581523 -0.104078
H 7.387843 -0.622488 1.183418
H -0.108108 1.475776 1.954602
H 0.273042 2.758783 0.778741
H 8.225423 -1.263812 -1.724523
H 8.009458 -2.467069 -0.438208
H -3.988265 1.977150 -0.262715
H -4.585713 1.927280 1.427005
H 10.095857 -0.163603 -0.388890
H 10.457449 -1.884602 -0.708074
H 9.879573 -1.375230 0.904772
H -2.322906 1.407760 2.137534
H -4.399494 -0.570610 1.444812
H -3.683073 -0.543785 -0.195311
H -5.857385 0.479812 -0.926648
H -6.429428 -1.818829 0.887653
H -5.889369 -2.056182 -0.798486
H -8.458780 -0.654438 0.171019
H -7.914601 -0.616132 -1.528373
H -9.527797 -2.563167 -0.770492
H -8.084629 -3.142942 -1.458069


