%chk=000115911.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115911

1 1
 O  -0.2255000     -0.1615000      0.5390000    
 O   -1.296700       1.455900     -0.6904000    
 N    3.458000     -0.1962000     -5.7999998E-02
 N   -2.458000      6.1299998E-02  0.7547000    
 C    2.126200     -0.6418000      0.5285000    
 C    3.698600       1.267200      0.2838000    
 C    4.578500      -1.044500      0.5261000    
 C    3.428800     -0.3657000      -1.570100    
 C    1.017000      0.2260000     -3.2400001E-02
 C   -3.784400      0.5896000      0.5336000    
 C   -1.328600      0.5394000      0.1242000    
 C   -4.510600     -0.1217000     -0.6019000    
 C   -4.703200      -1.608100     -0.3370000    
 H    1.973000      -1.699000      0.2805000    
 H    2.183900     -0.5571000       1.620500    
 H    3.521400       1.413900       1.353300    
 H    4.741500       1.501200      4.5400001E-02
 H    3.055400       1.909800     -0.3224000    
 H    4.385500      -2.091500      0.2741000    
 H    5.528500     -0.7173000      9.3199998E-02
 H    4.586400     -0.9059000       1.611300    
 H    3.087600      -1.378500      -1.804100    
 H    2.780500      0.3878000      -2.023500    
 H    4.447100     -0.2200000      -1.945200    
 H    1.159900       1.282100      0.2109000    
 H   0.9232000      0.1117000      -1.116000    
 H   -3.707000       1.658800      0.3084000    
 H   -4.338300      0.4809000       1.471900    
 H   -5.492000      0.3452000     -0.7446000    
 H   -3.954200      3.3000000E-03  -1.538400    
 H   -2.350400     -0.7083000       1.408500    
 H   -5.249400      -1.772400      0.5973000    
 H   -5.278500      -2.063000      -1.149800    
 H   -3.744500      -2.132000     -0.2735000    


%chk=000115911-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115911

1 1
O -0.196146 -0.129899 0.379891
O -1.289364 1.654386 -0.713951
N 3.555861 -0.159386 -0.069648
N -2.477053 0.051416 0.552308
C 2.108793 -0.516417 0.345922
C 3.958239 1.212446 0.475309
C 4.485955 -1.220031 0.525423
C 3.703768 -0.169130 -1.592134
C 1.036698 0.461628 -0.154487
C -3.843092 0.577122 0.328817
C -1.375958 0.630092 0.004173
C -4.703749 -0.334244 -0.575099
C -4.956801 -1.737573 0.016916
H 1.903531 -1.526918 -0.046221
H 2.092762 -0.555591 1.448343
H 3.780663 1.233395 1.561335
H 5.026703 1.376095 0.266995
H 3.363403 1.994866 -0.016380
H 4.194926 -2.209814 0.142315
H 5.522807 -0.995284 0.232434
H 4.394993 -1.203157 1.622051
H 3.359857 -1.140331 -1.979344
H 3.102789 0.641251 -2.027886
H 4.764231 -0.019137 -1.846259
H 1.161402 1.485976 0.241434
H 0.976549 0.519418 -1.256617
H -3.731415 1.576436 -0.124434
H -4.331360 0.701846 1.314404
H -5.671968 0.178919 -0.733047
H -4.223781 -0.417970 -1.568731
H -2.351280 -0.797104 1.106316
H -5.439223 -1.672860 1.010497
H -5.623841 -2.324744 -0.637933
H -4.019195 -2.316102 0.125190


