%chk=000134418.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134418

0 1
 O  -0.1676000      0.2726000      -1.906300    
 O    4.377800      -3.541800      9.6000001E-02
 O   -4.719800      -3.108500      0.6565000    
 N    3.824700       3.150000     -7.4600004E-02
 C  -7.4699998E-02 -0.1328000     -0.5270000    
 C   6.6000000E-03   1.244100      0.3256000    
 C    1.147500      -1.068800     -0.3563000    
 C   -1.346000     -0.9472000     -0.2026000    
 C   -1.123300       2.213100      0.2283000    
 C    1.389700       1.934300      0.1807000    
 C    1.565600      -1.781400      -1.445300    
 C   -1.789700     -0.9620000       1.092400    
 C    1.739600      -1.128900      0.8742000    
 C   -1.963600      -1.611900      -1.228000    
 C   -1.105100       3.210000     -0.7471000    
 C   -2.198100       2.122300       1.112800    
 C    1.930400       2.513900       1.286400    
 C    1.982400       1.920600      -1.043900    
 C    2.666500      -2.624000      -1.291100    
 C   -2.938200      -1.697700       1.384700    
 C    2.840700      -1.971200       1.028600    
 C   -3.112400      -2.347300     -0.9357000    
 C   -2.161700       4.116200     -0.8378000    
 C   -3.254700       3.028300       1.022000    
 C    3.304000      -2.718900     -5.4099999E-02
 C   -3.599600      -2.390300      0.3706000    
 C    3.165000       3.116300       1.105000    
 C    3.214500       2.549600      -1.121000    
 C   -3.236600       4.025300      4.6599999E-02
 C    4.982400      -3.591100       1.387600    
 C   -5.346600      -3.792900     -0.4273000    
 H   1.8700000E-02  0.9462000       1.381700    
 H   -1.013200      0.7336000      -2.039800    
 H    1.081400      -1.732400      -2.414300    
 H   -1.259200     -0.5193000       1.924800    
 H    1.388600     -0.5909000       1.745500    
 H   -1.599000      -1.609900      -2.249500    
 H  -0.3001000       3.302600      -1.468100    
 H   -2.221300       1.413700       1.930700    
 H    1.448600       2.521000       2.255900    
 H    1.587500       1.516000      -1.958600    
 H    3.021700      -3.205600      -2.137400    
 H   -3.301900      -1.744000       2.407700    
 H    3.284300      -2.003000       2.017900    
 H   -3.574600      -2.864500      -1.769600    
 H   -2.150000       4.890100      -1.599800    
 H   -4.083900       2.968200       1.720900    
 H    3.671500       3.604200       1.931200    
 H    3.757100       2.596900      -2.059600    
 H   -4.057900       4.732400     -2.2500001E-02
 H    4.291200      -3.985100       2.140400    
 H    5.398800      -2.619600       1.674300    
 H    5.820900      -4.292500       1.325300    
 H   -6.221300      -4.310500     -2.0099999E-02
 H   -4.690200      -4.559900     -0.8521000    
 H   -5.713400      -3.093700      -1.186300    


%chk=000134418-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134418

0 1
O -0.069538 0.319047 -1.923836
O 4.467478 -3.717161 -0.129646
O -4.686084 -3.225450 0.938450
N 3.781335 3.522835 0.430736
C -0.020076 -0.089348 -0.505999
C 0.030777 1.213412 0.406003
C 1.220916 -0.988380 -0.366090
C -1.281098 -0.924990 -0.152347
C -1.150309 2.145511 0.071928
C 1.356939 1.979358 0.377771
C 1.629261 -1.783223 -1.469728
C -1.472374 -1.437139 1.160407
C 1.926095 -1.121378 0.850505
C -2.254097 -1.227727 -1.128039
C -1.049314 3.126380 -0.952017
C -2.380606 2.019709 0.768197
C 1.727752 2.744955 1.512337
C 2.235047 2.012200 -0.734567
C 2.709111 -2.675093 -1.360915
C -2.608241 -2.193170 1.491624
C 3.012661 -2.015611 0.979830
C -3.404188 -1.990588 -0.816154
C -2.152770 3.949588 -1.275393
C -3.481265 2.844335 0.449167
C 3.405724 -2.798141 -0.132528
C -3.587117 -2.468077 0.502730
C 2.927168 3.489098 1.497793
C 3.416340 2.783847 -0.660440
C -3.373877 3.810466 -0.578213
C 5.224647 -3.868342 1.114355
C -5.714874 -3.551264 -0.051751
H -0.122573 0.867807 1.445945
H -0.785950 1.003294 -2.015746
H 1.095604 -1.684226 -2.418699
H -0.714616 -1.269240 1.934629
H 1.657488 -0.511308 1.719855
H -2.106620 -0.881146 -2.155442
H -0.093284 3.280280 -1.464749
H -2.479051 1.266208 1.557479
H 1.085504 2.769191 2.401002
H 2.009068 1.435248 -1.635082
H 3.031170 -3.286024 -2.209794
H -2.755309 -2.590725 2.500516
H 3.541304 -2.081731 1.935325
H -4.135247 -2.203110 -1.602079
H -2.052784 4.704936 -2.063036
H -4.420778 2.732847 1.001872
H 3.228104 4.083935 2.368127
H 4.110875 2.816525 -1.507900
H -4.226903 4.452521 -0.824346
H 4.578277 -4.227535 1.939168
H 5.707888 -2.916610 1.410006
H 5.994871 -4.621641 0.892737
H -6.467215 -4.136267 0.497263
H -5.299530 -4.159647 -0.878687
H -6.181714 -2.635338 -0.464034


