%chk=000136558.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136558

0 1
 O    4.755100      0.8335000      3.9999999E-04
 O    4.497900      -1.346600      6.0000003E-04
 N   -2.403400     -0.5267000      1.2000001E-03
 N    4.022500     -0.1852000      1.9999999E-04
 C   -3.817100     -0.1248000      1.9999999E-04
 C   -4.082700      0.7026000      -1.256900    
 C   -4.665600      -1.396000     -3.3000000E-03
 C   -4.085800      0.6980000       1.259900    
 C   -1.602300      0.4790000     -1.9999999E-04
 C  -0.1397000      0.3063000     -6.0000003E-04
 C   0.6761000       1.426200     -3.0000001E-04
 C   0.3929000     -0.9731000     -6.9999998E-04
 C    2.612500     -1.8900000E-02 -9.9999997E-05
 C    2.061400       1.262600     -9.9999997E-05
 C    1.778200      -1.136800     -5.0000002E-04
 H   -3.738600      0.1777000      -2.156000    
 H   -5.157900      0.8832000      -1.374700    
 H   -3.606600       1.688100      -1.248800    
 H   -4.454800      -2.012900      0.8777000    
 H   -4.452900      -2.009400     -0.8865000    
 H   -5.735900      -1.162300     -4.0000002E-03
 H   -3.606000       1.681600       1.258100    
 H   -5.161000      0.8814000       1.373700    
 H   -3.747100      0.1680000       2.157900    
 H   -1.926100       1.533700      9.9999997E-05
 H   0.2597000       2.429700       0.000000    
 H  -0.2337000      -1.860300     -8.9999998E-04
 H    2.680400       2.156200      9.9999997E-05
 H    2.172200      -2.149900     -5.0000002E-04


%chk=000136558-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000136558

0 1
O 4.920032 0.759108 -0.001198
O 4.574255 -1.496417 0.003155
N -2.409057 -0.367581 0.000070
N 4.146619 -0.276857 0.001275
C -3.891397 -0.083541 -0.000456
C -4.280170 0.716660 -1.275053
C -4.591934 -1.460850 -0.005464
C -4.280625 0.707674 1.279608
C -1.554694 0.616511 -0.001163
C -0.093921 0.370731 -0.000460
C 0.802002 1.474495 -0.002398
C 0.429323 -0.953544 0.002063
C 2.681223 -0.052665 0.000685
C 2.194595 1.272689 -0.001854
C 1.815614 -1.172971 0.002663
H -3.965587 0.173224 -2.183924
H -5.375662 0.853040 -1.314866
H -3.810505 1.717282 -1.287706
H -4.297109 -2.044102 0.884475
H -4.297225 -2.037797 -0.899564
H -5.691008 -1.344984 -0.005035
H -3.809599 1.707535 1.299746
H -5.376006 0.844986 1.319481
H -3.967359 0.157338 2.184759
H -1.847700 1.689599 -0.003267
H 0.402105 2.495454 -0.004365
H -0.280934 -1.785797 0.003517
H 2.903291 2.104603 -0.003328
H 2.243132 -2.178920 0.004605


