%chk=000095701.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095701

0 1
 O   0.3386000      0.7703000     -1.2000001E-03
 N   -1.175400     -0.9884000     -3.0000001E-04
 C    2.708500      0.4289000      1.9900000E-02
 C    3.836200     -0.5991000      5.7999999E-03
 C    1.340200     -0.2375000     -3.9999999E-04
 C    5.200700      7.1000002E-02 -1.7500000E-02
 C  -0.9650000      0.3469000     -1.1000000E-03
 C   -1.977900       1.292200     -1.9000000E-03
 C   -3.291900      0.8375000     -1.9000000E-03
 C   -3.548900     -0.5290000     -1.0000000E-03
 C   -2.465400      -1.392700     -3.9999999E-04
 H    2.789400       1.069900      0.9068000    
 H    2.796400       1.100400     -0.8435000    
 H    3.740600      -1.245900     -0.8741000    
 H    3.764900      -1.242400      0.8905000    
 H    1.248500     -0.8551000     -0.9026000    
 H    1.233700     -0.8728000      0.8879000    
 H    5.316400      0.6950000     -0.9095000    
 H    5.342300      0.7029000      0.8650000    
 H    5.993500     -0.6836000     -2.5900001E-02
 H   -1.760600       2.354700     -2.4999999E-03
 H   -4.114200       1.546600     -2.4999999E-03
 H   -4.565100     -0.9061000     -1.0000000E-03
 H   -2.612000      -2.467800      3.0000001E-04


%chk=000095701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095701

0 1
O 0.326269 0.715778 -0.003070
N -1.266474 -1.041090 -0.001996
C 2.723837 0.399127 -0.000692
C 3.916790 -0.585461 -0.001960
C 1.381525 -0.333472 -0.004935
C 5.279253 0.140530 -0.002281
C -0.993105 0.288569 -0.000854
C -1.992076 1.301355 0.002684
C -3.336712 0.893600 0.005003
C -3.648703 -0.492544 0.003863
C -2.582596 -1.413342 0.000427
H 2.777860 1.053543 0.890787
H 2.780460 1.059086 -0.887918
H 3.849798 -1.246671 -0.889938
H 3.850717 -1.247628 0.885343
H 1.253100 -0.969560 -0.901001
H 1.250371 -0.975781 0.886225
H 5.384932 0.784226 -0.895676
H 5.384484 0.785848 0.890021
H 6.118874 -0.578246 -0.001363
H -1.695590 2.353240 0.003515
H -4.135448 1.642978 0.007705
H -4.683996 -0.844902 0.005606
H -2.770071 -2.493282 -0.000596


