%chk=000114010.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114010

1 1
 N    3.878400     -0.9052000      0.3699000    
 C   -2.434600     -0.5061000      0.7742000    
 C   -3.611900     -0.3348000     -0.1895000    
 C   -1.102100     -0.5132000      1.9900000E-02
 C   -4.972800     -0.2983000      0.5120000    
 C   0.1094000     -0.7527000      0.9255000    
 C   -6.143700     -5.2800000E-02 -0.4424000    
 C    1.442000     -0.7346000      0.1758000    
 C   -7.467700      4.6399999E-02  0.3203000    
 C    2.611600     -0.9403000       1.132500    
 C   -8.634600      0.3293000     -0.6286000    
 C   -9.978900      0.4684000      8.8799998E-02
 C    4.540700      0.2507000      0.1748000    
 C    4.309900      -2.082200     -0.1025000    
 C    5.746800      0.2330000     -0.5603000    
 C   -11.13790      0.7750000     -0.8468000    
 C    4.043600       1.451400      0.6911000    
 C    5.486100      -2.157700     -0.8297000    
 C    6.208800     -0.9922000      -1.059700    
 C    6.434600       1.440000     -0.7622000    
 C    4.740300       2.640500      0.4806000    
 C    5.932000       2.635300     -0.2438000    
 H   -2.435600      0.3070000       1.509800    
 H   -2.550000      -1.445400       1.328100    
 H   -3.478100      0.5951000     -0.7564000    
 H   -3.608200      -1.153600     -0.9196000    
 H   -1.126300      -1.292600     -0.7519000    
 H  -0.9780000      0.4442000     -0.5012000    
 H   -5.129100      -1.244900       1.044000    
 H   -4.957500      0.4927000       1.272100    
 H  -7.6000001E-03  -1.717900       1.433600    
 H   0.1254000      1.6899999E-02   1.707400    
 H   -6.196500     -0.8663000      -1.175800    
 H   -5.971000      0.8758000     -0.9999000    
 H    1.549100      0.2190000     -0.3542000    
 H    1.442100      -1.518300     -0.5914000    
 H   -7.653500     -0.8884000      0.8626000    
 H   -7.403800      0.8471000       1.067100    
 H    2.535700      -1.928400       1.606300    
 H    2.635300     -0.2389000       1.969200    
 H   -8.704100     -0.4779000      -1.368300    
 H   -8.431200       1.252300      -1.185800    
 H   -9.909800       1.266600      0.8375000    
 H   -10.19750     -0.4585000      0.6322000    
 H    3.709000      -2.962400      9.5899999E-02
 H   -11.26150     -2.0700000E-02  -1.588200    
 H   -10.97130       1.717000      -1.378600    
 H   -12.07070      0.8626000     -0.2813000    
 H    3.113600       1.535900       1.240400    
 H    5.836900      -3.109200      -1.215000    
 H    7.132800      -1.045600      -1.630600    
 H    7.365600       1.459200      -1.324400    
 H    4.352000       3.574900      0.8760000    
 H    6.470600       3.564400     -0.4067000    


%chk=000114010-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114010

1 1
N 3.959495 -0.986486 0.442033
C -2.459238 -0.455659 0.713805
C -3.651956 -0.107437 -0.205123
C -1.095066 -0.370246 -0.007768
C -5.019220 -0.219940 0.506387
C 0.096323 -0.700531 0.921078
C -6.213289 0.138553 -0.406720
C 1.452216 -0.656071 0.176825
C -7.581067 0.015576 0.302262
C 2.620671 -0.977515 1.135255
C -8.776539 0.378630 -0.607179
C -10.144095 0.253807 0.102896
C 4.641003 0.218646 0.175141
C 4.464998 -2.186057 0.036882
C 5.905074 0.148437 -0.531405
C -11.333342 0.618323 -0.811520
C 4.128567 1.484182 0.582170
C 5.688002 -2.288145 -0.657456
C 6.409061 -1.122843 -0.940481
C 6.618263 1.361173 -0.802985
C 4.856112 2.646310 0.299874
C 6.104620 2.591394 -0.394279
H -2.459474 0.228803 1.587676
H -2.597531 -1.479518 1.119138
H -3.527078 0.923773 -0.596457
H -3.644480 -0.779083 -1.089015
H -1.095213 -1.067464 -0.871050
H -0.965628 0.648674 -0.427631
H -5.149849 -1.253584 0.889501
H -5.027156 0.444454 1.395859
H -0.054433 -1.707240 1.362264
H 0.107300 0.016365 1.768245
H -6.204228 -0.520922 -1.299843
H -6.089132 1.174980 -0.784609
H 1.590682 0.341442 -0.282469
H 1.443565 -1.392304 -0.650806
H -7.708492 -1.021849 0.676504
H -7.590564 0.671887 1.197802
H 2.479885 -1.978406 1.577982
H 2.666808 -0.259460 1.970870
H -8.770099 -0.276624 -1.503578
H -8.653285 1.416756 -0.981038
H -10.150550 0.908665 0.998277
H -10.267505 -0.783412 0.476199
H 3.872112 -3.070033 0.282749
H -11.370278 -0.042883 -1.697921
H -11.250486 1.660228 -1.174422
H -12.297398 0.522421 -0.279450
H 3.176684 1.568916 1.109446
H 6.046762 -3.275348 -0.954490
H 7.362702 -1.176452 -1.475715
H 7.572873 1.303007 -1.336094
H 4.459147 3.615679 0.616935
H 6.650548 3.516032 -0.601750


