%chk=000032938.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032938

0 1
 O   0.5452000       1.185600      0.7580000    
 O    2.218600       1.372600     -0.8194000    
 N   -2.708400       1.342300     -0.5481000    
 C  -5.9700001E-02  0.1222000     -6.3999998E-03
 C   -1.364500     -0.3447000      0.7150000    
 C  -0.4365000      0.7693000      -1.360100    
 C   -2.388000      0.8125000      0.7839000    
 C   -1.505700       1.860200      -1.210000    
 C   -2.005200      -1.585400      7.1199998E-02
 C   0.9992000     -0.9771000     -8.9199997E-02
 C   -3.729900       2.385000     -0.4539000    
 C    1.546100      -1.324400      -1.323400    
 C    1.415700      -1.630400       1.069500    
 C   -3.238300      -1.989800      0.8097000    
 C    1.685700       1.718300      0.2261000    
 C    2.512100      -2.327900      -1.399100    
 C    2.381700      -2.633700      0.9939000    
 C    2.188300       2.811100       1.140100    
 C    2.929900      -2.982500     -0.2404000    
 C   -4.456200      -2.025900      0.2576000    
 C    3.469800       3.442900      0.6250000    
 H   -1.120500     -0.5840000       1.759900    
 H  -0.8471000       0.000000      -2.029100    
 H   0.3802000       1.214100      -1.931200    
 H   -3.302700      0.4953000       1.296500    
 H   -1.972700       1.614000       1.411700    
 H   -1.093500       2.720500     -0.6670000    
 H   -1.768400       2.213400      -2.215100    
 H   -1.311300      -2.432800      0.1015000    
 H   -2.233500      -1.412400     -0.9864000    
 H   -4.647500       1.985200     -8.2000000E-03
 H   -4.000200       2.750200      -1.450900    
 H   -3.397000       3.238400      0.1479000    
 H    1.252300     -0.8530000      -2.254600    
 H    1.011600      -1.366400       2.042400    
 H   -3.129300      -2.283100       1.850700    
 H    2.938300      -2.601000      -2.360000    
 H    2.709200      -3.141500       1.896300    
 H    1.411500       3.578700       1.220800    
 H    2.370400       2.378300       2.129500    
 H    3.682300      -3.763500     -0.2991000    
 H   -5.315200      -2.334600      0.8431000    
 H   -4.619200      -1.748600     -0.7780000    
 H    3.317900       3.889900     -0.3631000    
 H    3.809100       4.227900       1.307600    
 H    4.267100       2.697500      0.5360000    


%chk=000032938-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000032938

0 1
O 0.562258 1.208877 0.683737
O 2.366537 1.661658 -0.748531
N -2.632316 1.458210 -0.706097
C -0.038787 0.126923 -0.220377
C -1.334458 -0.254551 0.571157
C -0.419639 0.740118 -1.585813
C -2.291080 0.960862 0.648922
C -1.420057 1.901311 -1.433662
C -2.062255 -1.492891 -0.036179
C 0.962057 -1.034628 -0.277625
C -3.677774 2.497352 -0.672103
C 1.339574 -1.659499 -1.490600
C 1.507497 -1.529266 0.937097
C -3.025561 -2.119916 0.949286
C 1.754643 1.844931 0.327115
C 2.235831 -2.752136 -1.492055
C 2.405161 -2.616806 0.938741
C 2.191824 2.773688 1.454339
C 2.771403 -3.237490 -0.278614
C -4.364962 -2.245953 0.769151
C 3.312493 3.740103 1.031137
H -1.017334 -0.503784 1.603890
H -0.901034 -0.048736 -2.193059
H 0.486559 1.080791 -2.112804
H -3.225177 0.644725 1.149585
H -1.820500 1.761408 1.271207
H -0.923413 2.762892 -0.916079
H -1.722103 2.253393 -2.437877
H -1.308013 -2.249030 -0.332062
H -2.606506 -1.177412 -0.944413
H -4.583014 2.098075 -0.180523
H -3.947050 2.790172 -1.703287
H -3.365882 3.422118 -0.122016
H 0.950946 -1.290299 -2.444335
H 1.237682 -1.046721 1.883685
H -2.574692 -2.502042 1.880453
H 2.519348 -3.219693 -2.441712
H 2.819445 -2.980705 1.885969
H 1.302304 3.313931 1.827397
H 2.528333 2.132325 2.293791
H 3.467518 -4.083675 -0.280303
H -5.005271 -2.722072 1.520818
H -4.855422 -1.879014 -0.141278
H 2.970468 4.423252 0.234225
H 3.641848 4.347956 1.892412
H 4.180271 3.183946 0.638488


