%chk=000094582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094582

0 1
 O   -2.055100     -0.1074000       1.431300    
 N   0.4430000     -0.2578000      0.4216000    
 N  -0.3817000      0.2464000     -0.3676000    
 C    1.818500      4.6999999E-03  2.9000000E-03
 C   -1.781400     -4.3000001E-03  2.9500000E-02
 C    2.030200       1.517800     -3.6600001E-02
 C    2.751400     -0.6423000       1.026100    
 C    2.027700     -0.6103000      -1.380500    
 C   -2.239900      -1.310300     -0.6211000    
 C   -2.612800       1.163700     -0.5056000    
 H    1.414000       2.007400     -0.7995000    
 H    1.783600       1.977400      0.9276000    
 H    3.075100       1.758800     -0.2633000    
 H    2.581700      -1.723500       1.086600    
 H    2.583500     -0.2319000       2.028400    
 H    3.802900     -0.4793000      0.7658000    
 H    1.410500     -0.1316000      -2.149300    
 H    3.072200     -0.5101000      -1.697200    
 H    1.780100      -1.678200      -1.380500    
 H   -2.105200      -1.290600      -1.707900    
 H   -1.669700      -2.159300     -0.2262000    
 H   -3.294300      -1.511800     -0.4010000    
 H   -2.505800       1.274300      -1.590200    
 H   -3.674800       1.033900     -0.2686000    
 H   -2.298400       2.104600     -3.8899999E-02
 H   -1.618700      0.6493000       1.858500    


%chk=000094582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094582

0 1
O -1.934987 0.368924 1.333375
N 0.371792 0.194820 0.336448
N -0.463102 -0.114724 -0.585995
C 1.840108 0.163855 -0.027001
C -1.901045 -0.036825 -0.059191
C 2.352454 1.597554 0.269072
C 2.473041 -0.846802 0.965152
C 2.111668 -0.239717 -1.490217
C -2.491443 -1.452575 -0.210672
C -2.623121 1.009030 -0.930641
H 1.900905 2.328320 -0.425357
H 2.102180 1.897721 1.301737
H 3.449866 1.633551 0.148442
H 2.108823 -1.871042 0.769505
H 2.223914 -0.580976 2.007403
H 3.571939 -0.839870 0.853389
H 1.637856 0.465424 -2.194596
H 3.201634 -0.244134 -1.671722
H 1.711230 -1.244518 -1.708459
H -2.449049 -1.788887 -1.260919
H -1.936899 -2.165693 0.422772
H -3.542309 -1.434325 0.124245
H -2.584802 0.729598 -1.997587
H -3.676036 1.071557 -0.607634
H -2.158880 2.001038 -0.797560
H -0.959138 0.488296 1.580313


