%chk=000088800.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088800

0 1
 O    1.209100      -2.381200     -0.8251000    
 O   6.6900000E-02   1.280100       1.884300    
 O    3.728200       1.453900     -0.8762000    
 N    2.408500     -0.4280000     -0.9223000    
 N    1.838200       1.400600      0.4316000    
 C   0.1976000     -0.4004000      0.1409000    
 C  -0.5868000      -1.335000       1.073300    
 C  -0.7406000      0.1229000     -0.9614000    
 C    1.307000      -1.185100     -0.5522000    
 C   0.6836000      0.8133000      0.9270000    
 C   0.3091000      -1.906800       2.150600    
 C   -1.926700      0.8088000     -0.3638000    
 C    2.719400      0.8574000     -0.4956000    
 C   -3.222300      0.4606000     -0.4804000    
 C   -4.374500       1.193100      0.1466000    
 C   -3.616800     -0.7543000      -1.277300    
 H   -1.032300      -2.164200      0.5090000    
 H   -1.412600     -0.8212000       1.579000    
 H  -0.2172000      0.8591000      -1.587400    
 H   -1.011200     -0.6838000      -1.649300    
 H    1.119400      -2.520500       1.747200    
 H   0.7525000      -1.131200       2.782000    
 H  -0.2803000      -2.555100       2.808800    
 H   -1.724000       1.724300      0.1883000    
 H    3.101900     -0.8897000      -1.504300    
 H    2.111200       2.286800      0.8474000    
 H   -5.078800       1.524900     -0.6229000    
 H   -4.903600      0.5439000      0.8515000    
 H   -4.038100       2.078500      0.6962000    
 H   -2.854100      -1.536000      -1.298900    
 H   -3.865900     -0.4678000      -2.303900    
 H   -4.503700      -1.223700     -0.8359000    


%chk=000088800-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088800

0 1
O 1.089401 -2.277842 -1.100351
O 0.127856 1.442986 1.846672
O 4.013075 1.310909 -0.691604
N 2.494340 -0.455548 -0.899977
N 1.997951 1.382802 0.494332
C 0.220754 -0.361738 0.172289
C -0.505740 -1.325530 1.151665
C -0.806735 0.176588 -0.937778
C 1.285468 -1.127342 -0.629899
C 0.758565 0.861538 0.926237
C 0.413799 -1.940378 2.226628
C -2.047588 0.827999 -0.375046
C 2.911057 0.787957 -0.392796
C -3.338707 0.416770 -0.548630
C -4.483482 1.215870 0.054186
C -3.771651 -0.812700 -1.327116
H -0.964025 -2.127514 0.544906
H -1.319281 -0.753024 1.629165
H -0.262289 0.895701 -1.584367
H -1.056796 -0.697970 -1.562572
H 1.219110 -2.548590 1.775706
H 0.869835 -1.160049 2.862843
H -0.169796 -2.604861 2.888281
H -1.876699 1.733408 0.223107
H 3.166834 -0.934907 -1.507686
H 2.310540 2.255256 0.933188
H -5.178289 1.568739 -0.733706
H -5.082305 0.588881 0.744405
H -4.121821 2.094633 0.614363
H -2.932608 -1.404019 -1.727665
H -4.419334 -0.524290 -2.178565
H -4.378340 -1.479533 -0.683416


