%chk=000047386.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047386

0 1
 N  -0.8240000      4.5400001E-02  0.9010000    
 C   0.3497000     -6.5000001E-03  1.0500000E-02
 C    1.607200     -3.6499999E-02  0.9207000    
 C   0.3020000       1.251500     -0.9066000    
 C   0.2388000      -1.261700     -0.9065000    
 C    2.947500     -4.5200001E-02  0.1764000    
 C   0.3981000       2.604500     -0.1889000    
 C   0.2658000      -2.622200     -0.1978000    
 C   -2.047200      5.5500001E-02  0.1218000    
 C   -3.262900      9.4499998E-02   1.044300    
 C    4.115400     -0.1580000       1.146100    
 C   0.4044000       3.756000      -1.184400    
 C   6.6100001E-02  -3.761300      -1.187900    
 C   -4.560700      8.3999999E-02  0.2512000    
 H    1.566100     -0.9177000       1.574900    
 H    1.594400      0.8206000       1.607000    
 H    1.162300       1.192300      -1.589100    
 H  -0.5484000       1.248400      -1.597300    
 H  -0.6139000      -1.208800      -1.592600    
 H    1.095300      -1.247600      -1.595600    
 H  -0.8210000     -0.7474000       1.540800    
 H    2.999200     -0.8881000     -0.5194000    
 H    3.068300      0.8727000     -0.4077000    
 H  -0.4461000       2.734800      0.4966000    
 H    1.315800       2.665200      0.4042000    
 H    1.223200      -2.769100      0.3126000    
 H  -0.5239000      -2.682500      0.5577000    
 H   -2.177200     -0.8414000     -0.4881000    
 H   -2.142700      0.9353000     -0.5183000    
 H   -3.232500      0.9949000       1.670000    
 H   -3.253500     -0.7699000       1.719800    
 H    4.057500      -1.085700       1.724400    
 H    4.126900      0.6839000       1.845600    
 H    5.063300     -0.1579000      0.5989000    
 H  -0.5133000       3.763200      -1.781200    
 H    1.258100       3.681900      -1.865600    
 H   0.4733000       4.712400     -0.6565000    
 H  -0.9023000      -3.678300      -1.691500    
 H   9.6699998E-02  -4.724200     -0.6683000    
 H   0.8521000      -3.761300      -1.949700    
 H   -4.623500      0.9524000     -0.4123000    
 H   -4.642600     -0.8217000     -0.3582000    
 H   -5.418800      0.1139000      0.9300000    


%chk=000047386-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047386

0 1
N -0.856266 0.082055 0.728594
C 0.375311 -0.007100 -0.122378
C 1.562105 -0.054400 0.890284
C 0.459771 1.258256 -1.034196
C 0.373524 -1.268375 -1.058377
C 2.984568 -0.088982 0.289257
C 0.516246 2.613225 -0.296735
C 0.250303 -2.636070 -0.350329
C -2.187705 -0.012416 0.096416
C -3.297043 0.180387 1.152377
C 4.073042 -0.160857 1.383025
C 0.375018 3.810930 -1.261404
C 0.157374 -3.808406 -1.352122
C -4.714658 0.075527 0.550710
H 1.436117 -0.945820 1.541955
H 1.469921 0.822709 1.559745
H 1.342906 1.156790 -1.696958
H -0.419061 1.260072 -1.712332
H -0.466866 -1.166613 -1.777041
H 1.294348 -1.261704 -1.676338
H -0.787830 -0.555235 1.535146
H 3.092456 -0.960116 -0.386941
H 3.152062 0.812985 -0.331699
H -0.287217 2.631560 0.463678
H 1.473821 2.703573 0.253921
H 1.119638 -2.798354 0.317293
H -0.648648 -2.638828 0.299711
H -2.366379 -0.981867 -0.434630
H -2.279689 0.784692 -0.666421
H -3.153892 1.164962 1.636808
H -3.177115 -0.583479 1.949633
H 3.957789 -1.073399 1.998381
H 4.011039 0.709878 2.063011
H 5.087667 -0.175516 0.943913
H -0.595725 3.780642 -1.792544
H 1.173922 3.804941 -2.027858
H 0.433175 4.774490 -0.721741
H -0.723741 -3.697135 -2.012258
H 0.070589 -4.780858 -0.832847
H 1.054668 -3.848847 -1.998336
H -4.873388 0.844590 -0.228677
H -4.879075 -0.914216 0.083899
H -5.490081 0.216627 1.325404


