%chk=000155460.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155460

0 1
 O    1.086100      -1.961100     -0.7089000    
 N    1.629300      0.1157000      0.2765000    
 C   -4.910000      4.7600001E-02  0.1231000    
 C   -3.395100     -0.2004000      3.4800000E-02
 C   -5.548800     -0.4478000       1.440500    
 C   -5.624400     -0.6846000      -1.033400    
 C   -5.195700       1.561400      1.9200001E-02
 C   -2.733600      0.2049000      -1.097200    
 C   -2.773500     -0.8178000       1.091300    
 C  -0.6925000     -0.6464000     -0.1242000    
 C   -1.359600     -2.1900000E-02  -1.178100    
 C   -1.399500      -1.044400       1.010500    
 C    1.108300       1.364500      0.8551000    
 C   0.7404000     -0.8818000     -0.2070000    
 C    1.579500       2.597900      9.4099998E-02
 C    3.062400     -9.8499998E-02  0.1990000    
 C    1.125500       2.601800      -1.358700    
 C    3.541200     -0.8704000     -0.8237000    
 C    3.850800      0.4834000       1.153300    
 C    4.918700      -1.076700     -0.8980000    
 C    5.228300      0.2773000       1.078800    
 C    5.762300     -0.5028000      5.2999999E-02
 H   -5.128600      5.9799999E-02   2.316800    
 H   -5.433700      -1.530200       1.571200    
 H   -6.627200     -0.2452000       1.449600    
 H   -5.412100      -1.760200      -1.010500    
 H   -5.320300     -0.3100000      -2.016800    
 H   -6.711600     -0.5588000     -0.9679000    
 H   -4.883300       1.980900     -0.9433000    
 H   -6.267400       1.768500      0.1230000    
 H   -4.671800       2.116900      0.8061000    
 H   -3.231300      0.6903000      -1.929600    
 H   -3.271600      -1.146800       1.994100    
 H  -0.8211000      0.2840000      -2.071100    
 H  -0.8888000      -1.531200       1.837400    
 H    1.408200       1.417400       1.907400    
 H   1.7400000E-02   1.386200      0.8824000    
 H    1.175600       3.489300      0.5892000    
 H    2.668600       2.701400      0.1232000    
 H   3.3900000E-02   2.594000      -1.426600    
 H    1.479900       3.510600      -1.856200    
 H    1.519900       1.745900      -1.914000    
 H    2.948000      -1.262700      -1.639600    
 H    3.474600       1.077500       1.977000    
 H    5.337500      -1.666600      -1.708300    
 H    5.885400      0.7207000       1.821300    
 H    6.835300     -0.6601000     -7.3000002E-03


%chk=000155460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155460

0 1
O 0.999715 -0.904998 -1.952505
N 1.632186 0.309803 -0.020463
C -5.127266 -0.160944 0.246612
C -3.601184 -0.155744 -0.004502
C -5.481288 -0.394490 1.737740
C -5.783903 -1.297742 -0.594599
C -5.725060 1.211738 -0.188252
C -3.098945 0.048889 -1.321152
C -2.651099 -0.362105 1.028991
C -0.778294 -0.132000 -0.546361
C -1.718802 0.046878 -1.592288
C -1.263788 -0.345306 0.767325
C 1.262724 1.526031 0.769250
C 0.682651 -0.256411 -0.905659
C 2.027590 2.793623 0.313995
C 3.007811 -0.133258 0.040659
C 1.761346 3.159936 -1.161170
C 3.630880 -0.878740 -1.001988
C 3.772760 0.161657 1.207234
C 4.965471 -1.317527 -0.861425
C 5.105600 -0.279937 1.331116
C 5.716976 -1.024248 0.297362
H -5.062804 0.396143 2.387814
H -5.115880 -1.373758 2.098587
H -6.579547 -0.382597 1.861487
H -5.385205 -2.285727 -0.300410
H -5.598892 -1.166911 -1.675562
H -6.878763 -1.303512 -0.435687
H -5.533727 1.421521 -1.255713
H -6.820329 1.216184 -0.033315
H -5.288354 2.037276 0.403191
H -3.796956 0.201416 -2.152194
H -2.987566 -0.546724 2.053237
H -1.349105 0.164703 -2.616307
H -0.556341 -0.528122 1.584838
H 1.415022 1.346795 1.850361
H 0.186192 1.698362 0.624524
H 1.703739 3.623031 0.974565
H 3.113290 2.663246 0.475786
H 0.682142 3.319548 -1.346535
H 2.293783 4.087524 -1.438114
H 2.107353 2.358180 -1.837670
H 3.063325 -1.112808 -1.902014
H 3.331743 0.719637 2.037727
H 5.418922 -1.890678 -1.678217
H 5.663850 -0.041923 2.243767
H 6.753624 -1.364413 0.393430


