%chk=000163812.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163812

0 1
 O   0.8712000      -1.896800     -0.2499000    
 O    3.052000      -2.635100     -0.3148000    
 N    2.525900     -0.4297000      0.2202000    
 N   -3.839100     -4.6200000E-02 -5.6400001E-02
 C    1.377600       1.689800      0.7374000    
 C    1.368100      0.2656000      0.3317000    
 C    1.433000       2.624900     -0.4691000    
 C   0.3936000     -0.6002000      4.8300002E-02
 C   -1.057000     -0.4099000      1.2700000E-02
 C    1.415100       4.084400     -4.1999999E-02
 C    2.244900      -1.734100     -0.1308000    
 C   -1.691700     -1.4300000E-02  -1.166400    
 C   -1.828600     -0.6216000       1.156800    
 C   -3.067100      0.1515000      -1.148500    
 C   -3.198000     -0.4286000       1.070800    
 H   0.4741000       1.907000       1.321300    
 H    2.223800       1.886000       1.407700    
 H    2.342300       2.434000      -1.052000    
 H   0.5807000       2.438700      -1.133800    
 H    3.448000     -4.1700002E-02  0.3794000    
 H    2.273700       4.317100      0.5959000    
 H   0.5007000       4.319900      0.5119000    
 H    1.457600       4.736600     -0.9200000    
 H   -1.132600      0.1621000      -2.079900    
 H   -1.378900     -0.9298000       2.095400    
 H   -3.601200      0.4580000      -2.041800    
 H   -3.835800     -0.5816000       1.935100    


%chk=000163812-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163812

0 1
O 0.871571 -1.807118 0.504754
O 3.076275 -2.641385 0.813347
N 2.521103 -0.306909 0.720094
N -3.984021 -0.328277 -0.114504
C 1.350283 1.942283 0.561542
C 1.331742 0.439122 0.557542
C 1.581707 2.570033 -0.844906
C 0.312294 -0.485716 0.417077
C -1.130319 -0.406640 0.227345
C 1.619660 4.111263 -0.789562
C 2.290595 -1.688014 0.698542
C -1.805565 0.801285 -0.113217
C -1.929817 -1.576770 0.373964
C -3.207272 0.787646 -0.262832
C -3.324624 -1.487221 0.195538
H 0.401744 2.322685 0.981498
H 2.149191 2.294612 1.244785
H 2.530182 2.183909 -1.266389
H 0.779983 2.233921 -1.530370
H 3.451854 0.083399 0.853340
H 2.436024 4.469803 -0.134835
H 0.670228 4.522067 -0.397836
H 1.781889 4.539251 -1.794663
H -1.262526 1.734199 -0.284212
H -1.460474 -2.532357 0.621421
H -3.744109 1.707563 -0.521918
H -3.955299 -2.376632 0.303655


