%chk=000162348.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162348

1 1
 O   -7.663100     -0.4058000     -0.4594000    
 N    2.954500      -1.128900     -0.4232000    
 N  -5.1600002E-02 -0.2043000      0.3798000    
 N   -1.356800     -0.1653000      3.8500000E-02
 C    2.974100       1.201700     -9.5600002E-02
 C    4.358600      0.6305000      1.6400000E-02
 C    2.190800     -8.1799999E-02 -0.3964000    
 C    4.289700     -0.7476000     -0.1817000    
 C    2.509400       1.826000       1.220700    
 C    2.871000       2.193700      -1.255300    
 C    5.570400       1.250400      0.2698000    
 C    5.416600      -1.551300     -0.1359000    
 C    2.617500      -2.539800     -0.6523000    
 C   0.7284000     -6.1200000E-02 -0.6322000    
 C    6.719300      0.4570000      0.3205000    
 C    6.642600     -0.9318000      0.1194000    
 C   -2.275800      0.1982000       1.103600    
 C   -3.709500      3.7700001E-02  0.6879000    
 C   -4.353700      -1.175700      0.8968000    
 C   -4.377400       1.104300      9.8099999E-02
 C   -5.685700      -1.325000      0.5104000    
 C   -5.709500      0.9552000     -0.2884000    
 C   -6.363600     -0.2595000     -8.2199998E-02
 C   -8.296200      0.7234000      -1.059200    
 H    3.149800       2.666000       1.512900    
 H    1.483500       2.202700       1.140900    
 H    2.525300       1.097600       2.040400    
 H    1.844000       2.557400      -1.373200    
 H    3.517800       3.064100      -1.097600    
 H    3.161800       1.732500      -2.207000    
 H    5.634100       2.321700      0.4262000    
 H    5.375000      -2.623800     -0.2896000    
 H    2.897700      -3.119700      0.2315000    
 H    3.151700      -2.892900      -1.538900    
 H    1.541200      -2.634700     -0.8192000    
 H   0.4205000      7.6700002E-02  -1.683600    
 H    7.683800      0.9174000      0.5177000    
 H    7.549200      -1.529700      0.1630000    
 H   -1.517800      0.4173000     -0.7834000    
 H   -2.094200       1.233600       1.419800    
 H   -2.088300     -0.4224000       1.989700    
 H   -3.835300      -2.013000       1.355800    
 H   -3.876100       2.053900     -6.8400003E-02
 H   -6.189900      -2.273700      0.6730000    
 H   -6.175600       1.822500     -0.7432000    
 H   -7.816800      0.9983000      -2.004900    
 H   -8.356700       1.567500     -0.3638000    
 H   -9.324300      0.4298000      -1.295600    


%chk=000162348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000162348

1 1
O -7.184660 -0.110356 -1.835892
N 2.747040 -0.747927 0.574927
N -0.173777 -0.001031 0.854418
N -1.423683 0.433981 0.931426
C 3.184506 1.366845 -0.418837
C 4.459000 0.532053 -0.325013
C 2.143195 0.414188 0.205473
C 4.153655 -0.714243 0.267506
C 3.298710 2.684562 0.408720
C 2.818829 1.685908 -1.902060
C 5.777101 0.811027 -0.715357
C 5.115043 -1.714872 0.492631
C 2.142791 -1.935307 1.211574
C 0.777861 0.799184 0.330845
C 6.769787 -0.179640 -0.499859
C 6.441876 -1.423510 0.095013
C -2.503193 -0.430915 1.479095
C -3.755559 -0.328607 0.628700
C -3.770272 -0.837686 -0.701108
C -4.931360 0.270215 1.138800
C -4.923755 -0.747464 -1.493454
C -6.103852 0.365066 0.357489
C -6.099517 -0.143964 -0.967363
C -8.443156 0.482618 -1.357286
H 4.101811 3.311705 -0.014890
H 2.360688 3.265847 0.368140
H 3.543619 2.480810 1.465044
H 1.875720 2.256701 -1.969132
H 3.618132 2.301638 -2.349067
H 2.718736 0.765633 -2.502492
H 6.045217 1.767284 -1.176655
H 4.868858 -2.677070 0.950701
H 2.653239 -2.133743 2.169932
H 2.270998 -2.810486 0.550737
H 1.075987 -1.755631 1.386559
H 0.533027 1.811802 -0.029181
H 7.804402 0.017538 -0.797162
H 7.225529 -2.171586 0.249815
H -1.699117 1.368171 0.577873
H -2.713170 -0.118832 2.520096
H -2.085608 -1.452120 1.508205
H -2.874501 -1.318647 -1.113237
H -4.944197 0.659991 2.164320
H -4.952824 -1.141053 -2.513560
H -7.000338 0.823707 0.783462
H -8.305614 1.548437 -1.094572
H -8.839657 -0.075289 -0.488311
H -9.137151 0.394270 -2.204412


