%chk=000091930.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091930

0 1
 O    1.554200      -1.498400     -4.1700002E-02
 N  -0.6904000      6.0199998E-02 -0.3925000    
 N   -1.844800      0.4257000     -9.9299997E-02
 N   0.2219000       2.485000       1.742700    
 C    2.366600     -0.3281000     -0.1561000    
 C    1.610300      0.7286000      -1.004200    
 C   0.2094000       1.206700     -0.5565000    
 C    2.729300      0.1484000       1.250600    
 C    3.645600     -0.7387000     -0.9011000    
 C  -0.4018000       2.111300      -1.634900    
 C   -2.741900     -0.7170000      6.4999998E-02
 C   0.2158000       1.915700      0.7312000    
 C   -2.198300      -1.599500       1.188100    
 C   -4.125700     -0.1781000      0.4263000    
 C   -2.791500      -1.485400      -1.255200    
 C    2.241400      -2.536600      0.6376000    
 H    2.259900       1.607600      -1.121900    
 H    1.489100      0.2985000      -2.009900    
 H    3.074200       1.188400       1.230900    
 H    3.549900     -0.4251000       1.696600    
 H    1.881700      7.0600003E-02   1.939400    
 H    4.337500      -1.327500     -0.2892000    
 H    4.207100      0.1480000      -1.218500    
 H    3.413500      -1.328700      -1.795500    
 H  -0.5676000       1.560400      -2.568400    
 H   0.2651000       2.952700      -1.859500    
 H   -1.362200       2.548800      -1.335600    
 H   -2.060100      -1.025000       2.111500    
 H   -2.889900      -2.421100       1.406800    
 H   -1.232200      -2.051100      0.9363000    
 H   -4.508100      0.4850000     -0.3582000    
 H   -4.092400      0.4043000       1.354400    
 H   -4.846900     -0.9911000      0.5630000    
 H   -1.824900      -1.931000      -1.516900    
 H   -3.519600      -2.303000      -1.202800    
 H   -3.084600     -0.8301000      -2.083800    
 H    3.056800      -2.964400      4.8999999E-02
 H    1.518200      -3.350400      0.7632000    
 H    2.565000      -2.275900       1.647300    


%chk=000091930-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091930

0 1
O 1.423199 -1.084205 0.417077
N -0.835811 0.202249 -0.729622
N -1.626276 -0.021813 0.249009
N 0.307924 2.099894 2.083079
C 2.421851 -0.189104 -0.225956
C 1.552215 0.797240 -1.060368
C 0.199186 1.298259 -0.465962
C 3.299284 0.539265 0.821364
C 3.313214 -0.999762 -1.200173
C -0.307350 2.507190 -1.312286
C -2.681622 -1.081412 -0.013210
C 0.273245 1.715632 0.954188
C -2.370509 -2.188536 1.028617
C -4.024431 -0.386485 0.327413
C -2.684108 -1.648519 -1.447929
C 1.933612 -2.064187 1.373952
H 2.172964 1.676460 -1.313774
H 1.269377 0.301901 -2.008641
H 3.935307 1.291352 0.319521
H 3.972724 -0.168123 1.337937
H 2.684866 1.051960 1.578436
H 4.010638 -1.662046 -0.656189
H 3.921151 -0.321641 -1.827335
H 2.683287 -1.618498 -1.863498
H -0.407925 2.194147 -2.366201
H 0.407106 3.345677 -1.251665
H -1.290258 2.849651 -0.947830
H -2.305675 -1.757248 2.042610
H -3.170896 -2.950196 1.014410
H -1.408757 -2.679148 0.795782
H -4.256913 0.404629 -0.408237
H -3.977028 0.073911 1.329427
H -4.844599 -1.126706 0.314052
H -1.712576 -2.109418 -1.695274
H -3.475846 -2.414624 -1.536194
H -2.876331 -0.855928 -2.192352
H 2.674937 -2.753131 0.918657
H 1.051337 -2.645324 1.688515
H 2.379083 -1.583661 2.266851


