%chk=000170269.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170269

0 1
 O    3.472400      -1.288400      2.4100000E-02
 O    3.652900      0.8444000      0.9810000    
 O    2.440500       2.451500      -2.061700    
 O   -1.195900      -3.045900      -1.161300    
 O   -4.200900       2.084000      0.7961000    
 O   -5.035200     -0.1725000      0.6814000    
 O   -3.450300      -2.386600     -0.1050000    
 N   0.6398000      -1.701100     -0.8579000    
 C    1.216400     -0.4793000     -0.3112000    
 C    2.687100     -0.3531000     -0.7373000    
 C   0.3685000      0.7312000     -0.7343000    
 C    3.322700      0.9842000     -0.4032000    
 C    2.446700       2.199800     -0.6565000    
 C    1.007200       2.015100     -0.1705000    
 C    4.047100     -0.5313000       1.103900    
 C   -1.075800      0.4769000     -0.3190000    
 C   -1.589000     -0.8476000     -0.3927000    
 C  -0.7154000      -1.964800     -0.8353000    
 C    3.557700      -1.074100       2.440500    
 C    5.568300     -0.6399000       1.012200    
 C   -1.939900       1.513100      7.3299997E-02
 C   -2.923100      -1.135300     -6.7299999E-02
 C   -3.247100       1.199300      0.3939000    
 C   -3.724200     -8.6400002E-02  0.3269000    
 C   -5.330500       1.206700      0.9799000    
 H    1.150200     -0.6024000      0.7770000    
 H    2.795900     -0.5862000      -1.802800    
 H   0.3488000      0.7979000      -1.831200    
 H    4.265000       1.090400     -0.9573000    
 H    2.873700       3.081500     -0.1662000    
 H   0.4307000       2.887900     -0.4983000    
 H   0.9844000       1.997200      0.9265000    
 H    1.263900      -2.458700      -1.119000    
 H    3.791200      -2.138700       2.546300    
 H    4.000900     -0.5236000       3.277200    
 H    2.472300     -0.9710000       2.534500    
 H    5.897000      -1.680100       1.109100    
 H    5.930600     -0.2809000      4.2599998E-02
 H    6.055900     -3.4800000E-02   1.783700    
 H   -1.615800       2.545600      0.1281000    
 H    2.211000       1.630700      -2.527300    
 H   -5.663900       1.277100       2.021600    
 H   -6.144400       1.541000      0.3264000    
 H   -2.754200      -3.044400     -0.2556000    


%chk=000170269-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170269

0 1
O 3.521892 -1.367108 -0.024532
O 3.767958 0.763602 0.999219
O 2.447645 2.758241 -1.848200
O -1.187543 -3.224558 -0.609727
O -4.407376 2.163178 0.457316
O -5.271718 -0.081781 0.404547
O -3.534502 -2.438821 -0.117299
N 0.620578 -1.776302 -0.522008
C 1.209048 -0.487402 -0.123187
C 2.637391 -0.388001 -0.697730
C 0.339319 0.703955 -0.589860
C 3.305308 0.969731 -0.396373
C 2.408215 2.223170 -0.469319
C 0.959376 1.992447 0.008381
C 4.279557 -0.626363 1.058284
C -1.136190 0.476650 -0.242265
C -1.630649 -0.866609 -0.259524
C -0.729411 -2.016672 -0.478414
C 3.936392 -1.202216 2.429865
C 5.769690 -0.692784 0.705459
C -2.017243 1.556276 -0.007377
C -3.032568 -1.165634 -0.065471
C -3.368326 1.240597 0.207026
C -3.873955 -0.066786 0.178882
C -5.647133 1.341802 0.603275
H 1.282529 -0.438377 0.985027
H 2.636751 -0.643307 -1.772893
H 0.400635 0.748370 -1.704456
H 4.171603 1.129072 -1.067403
H 2.884073 3.015381 0.131587
H 0.378495 2.887043 -0.274587
H 0.943097 1.919704 1.112277
H 1.237666 -2.594460 -0.549891
H 4.278369 -2.248763 2.496730
H 4.435199 -0.615520 3.220407
H 2.848188 -1.172818 2.600926
H 6.086456 -1.745866 0.615326
H 5.968205 -0.190692 -0.256208
H 6.369896 -0.204417 1.492364
H -1.685306 2.595094 0.008013
H 1.824239 2.241965 -2.420790
H -6.042230 1.474496 1.625133
H -6.364030 1.640997 -0.180022
H -2.726389 -3.058112 -0.347213


