%chk=000052469.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052469

0 1
 O  -0.2373000      -1.295400     -0.4465000    
 O  -1.4800000E-02 -0.7463000       1.777500    
 N   -3.684000      -2.461600      0.1420000    
 C   -2.601500      -1.528100     -0.1673000    
 C   -1.255400      -2.233600     -0.1240000    
 C    1.349600      0.3387000      0.1113000    
 C    2.764200     -6.4599998E-02 -5.2999998E-03
 C   0.9212000       1.573000     -0.2224000    
 C   0.3051000     -0.6121000      0.6048000    
 C   -3.680600      -3.578800     -0.8018000    
 C   -4.974600      -1.774500      0.1160000    
 C  -0.4672000       2.047900     -0.1341000    
 C    3.554500      0.5154000     -0.9829000    
 C    3.271100      -1.013900      0.8657000    
 C   -1.306900       1.907900      -1.229500    
 C  -0.9163000       2.627900       1.043300    
 C    4.892000      0.1347000      -1.093100    
 C    4.608500      -1.394600      0.7558000    
 C    5.418900     -0.8203000     -0.2236000    
 C   -2.624500       2.357800      -1.145700    
 C   -2.234000       3.077800       1.127200    
 C   -3.088000       2.942800      3.2600001E-02
 H   -2.597900     -0.7099000      0.5638000    
 H   -2.739800      -1.057800      -1.150200    
 H   -1.172500      -3.009500     -0.8903000    
 H   -1.070700      -2.716000      0.8438000    
 H    1.609000       2.341800     -0.5660000    
 H   -2.846200      -4.263500     -0.6216000    
 H   -3.659800      -3.246800      -1.846200    
 H   -4.580000      -4.192600     -0.6681000    
 H   -5.781600      -2.457500      0.4038000    
 H   -5.205600      -1.364400     -0.8740000    
 H   -4.988100     -0.9528000      0.8409000    
 H    3.174900       1.243000      -1.694100    
 H    2.664700      -1.471400       1.641900    
 H  -0.9584000       1.452600      -2.152900    
 H  -0.2611000       2.738700       1.903300    
 H    5.521900      0.5772000      -1.859200    
 H    5.019600      -2.137000       1.433600    
 H    6.459900      -1.117500     -0.3099000    
 H   -3.290000       2.251100      -1.997400    
 H   -2.595300       3.532700       2.044900    
 H   -4.114300       3.292200      9.8200001E-02


%chk=000052469-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052469

0 1
O -0.379916 -1.240019 -0.555973
O 0.211106 -1.007934 1.687874
N -3.651437 -2.905088 0.401726
C -2.666113 -1.802061 0.327988
C -1.321789 -2.347996 -0.191538
C 1.314148 0.359299 -0.042094
C 2.752336 -0.042412 0.014405
C 0.917874 1.568654 -0.555576
C 0.336199 -0.659441 0.486719
C -4.340218 -3.156310 -0.879693
C -4.592634 -2.791470 1.532709
C -0.428205 2.159277 -0.666982
C 3.660847 0.384979 -0.996727
C 3.249978 -0.862698 1.066332
C -0.627958 3.187443 -1.634389
C -1.527884 1.804018 0.166835
C 5.023341 0.027170 -0.943469
C 4.614541 -1.220494 1.114586
C 5.509758 -0.776100 0.114948
C -1.884110 3.806244 -1.796180
C -2.782067 2.428896 0.011174
C -2.971335 3.426558 -0.974612
H -2.511399 -1.389032 1.340021
H -3.006339 -0.966439 -0.329468
H -1.444922 -2.898349 -1.136829
H -0.850901 -2.992151 0.569597
H 1.722835 2.220409 -0.925448
H -3.604976 -3.299511 -1.690766
H -5.022208 -2.320851 -1.180161
H -4.940344 -4.080796 -0.805048
H -5.207295 -3.707991 1.593738
H -5.289076 -1.918565 1.451115
H -4.031032 -2.696899 2.478373
H 3.291022 0.969038 -1.846891
H 2.570319 -1.193839 1.858032
H 0.212343 3.490092 -2.271634
H -1.392734 1.071027 0.968338
H 5.702780 0.360599 -1.735998
H 4.979130 -1.843818 1.938763
H 6.567726 -1.058198 0.153443
H -2.014498 4.586670 -2.554071
H -3.611034 2.149729 0.671491
H -3.947161 3.911059 -1.090357


