%chk=000145163.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145163

0 1
 O   -1.995500      -1.567500      -1.095600    
 O   -1.996600       1.575700      -1.086600    
 O   -1.910500      -1.629000       1.105200    
 O   -1.939500       1.602200       1.115800    
 N   -1.601100      -1.148300      3.7000000E-03
 N   -1.601800       1.150500      1.0300000E-02
 C   0.1896000      4.9999999E-03  -1.267000    
 C   0.2011000     -1.9000000E-03   1.264700    
 C    1.997100       1.259300     -5.9000002E-03
 C    1.997400      -1.255900     -1.2800000E-02
 C  -0.6720000      1.5000000E-03  2.7999999E-03
 C    1.106700       1.252600      -1.264000    
 C    1.106900      -1.242500      -1.270800    
 C    1.118200       1.245800       1.260200    
 C    1.118500      -1.249300       1.253400    
 C    2.881500      1.8000000E-03 -1.3400000E-02
 H  -0.3984000      7.4999998E-03  -2.193600    
 H  -0.3778000     -4.1000000E-03   2.197200    
 H    2.630700       2.153300     -6.3999998E-03
 H    2.631200      -2.149800     -1.7999999E-02
 H   0.5233000       2.178700      -1.308700    
 H    1.737800       1.247600      -2.162000    
 H    1.738000      -1.232400      -2.168700    
 H   0.5239000      -2.168400      -1.320600    
 H    1.758100       1.234500       2.152000    
 H   0.5388000       2.173500       1.316400    
 H   0.5417000      -2.178700       1.305600    
 H    1.758800      -1.241500       2.145000    
 H    3.531400      4.1999999E-03 -0.8971000    
 H    3.539500     -5.0000002E-04  0.8643000    


%chk=000145163-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145163

0 1
O -2.041101 -1.656748 -1.131598
O -2.043759 1.660562 -1.121569
O -2.028818 -1.662959 1.146891
O -2.033163 1.651344 1.156945
N -1.647956 -1.219085 0.006781
N -1.650922 1.215676 0.014069
C 0.220850 0.004299 -1.278898
C 0.235768 -0.003291 1.278077
C 2.031450 1.270368 -0.007177
C 2.033607 -1.266218 -0.014701
C -0.626067 -0.000422 0.004497
C 1.125260 1.274193 -1.267357
C 1.127365 -1.264108 -1.274876
C 1.140156 1.266564 1.263530
C 1.142398 -1.271454 1.256060
C 2.928475 0.002841 -0.016476
H -0.442833 0.006321 -2.158251
H -0.417616 -0.006486 2.165084
H 2.664317 2.178274 -0.008189
H 2.668015 -2.173026 -0.021093
H 0.512265 2.193677 -1.309906
H 1.743628 1.260072 -2.184722
H 1.745638 -1.243656 -2.192185
H 0.515849 -2.184338 -1.322739
H 1.769165 1.247018 2.173523
H 0.527804 2.185855 1.318732
H 0.531634 -2.192095 1.305890
H 1.771381 -1.256080 2.166155
H 3.581593 0.006024 -0.911652
H 3.592618 0.000779 0.870557


