%chk=000096096.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096096

0 1
 O   -2.088800      -2.195000     -4.5899998E-02
 O   0.4632000      -1.694500     -0.5406000    
 N    2.546900     -0.3864000      0.7198000    
 N    1.253300      0.1076000      0.6893000    
 C    3.465200      0.5809000      0.1209000    
 C    3.118900      0.7991000      -1.349300    
 C    4.899000      8.4899999E-02  0.2783000    
 C   -1.079400     -2.0600000E-02  2.3200000E-02
 C   0.2793000     -0.6229000      3.1599998E-02
 C   -2.191400     -0.8364000     -1.4700000E-02
 C   -1.178800       1.356000      5.4200001E-02
 C   -3.457600     -0.2513000     -2.2100000E-02
 C   -2.445100       1.941100      4.6700001E-02
 C   -3.584500       1.137500      8.6000003E-03
 H    3.386900       1.541400      0.6474000    
 H    2.787100     -0.5261000       1.700800    
 H    3.854400       1.460800      -1.820600    
 H    3.119700     -0.1444000      -1.907000    
 H    2.138900       1.270800      -1.477500    
 H    5.156600     -4.7600001E-02   1.335000    
 H    5.606700      0.8049000     -0.1467000    
 H    5.050400     -0.8742000     -0.2299000    
 H    1.064000      0.9559000       1.213500    
 H  -0.3162000       2.014700      5.1800001E-02
 H   -4.354100     -0.8649000     -5.2200001E-02
 H   -2.544300       3.022600      6.3100003E-02
 H   -4.570300       1.593200      1.0000000E-03
 H   -2.981300      -2.580800     -7.0000000E-02


%chk=000096096-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096096

0 1
O -2.063875 -2.153268 0.515108
O 0.469774 -1.571164 -1.157631
N 2.562666 -0.505995 0.498592
N 1.206849 -0.136776 0.559457
C 3.522578 0.590227 0.200892
C 3.301688 1.111676 -1.232016
C 4.943733 0.024740 0.393129
C -1.116454 -0.029576 -0.109931
C 0.242402 -0.678814 -0.302166
C -2.265074 -0.799321 0.218376
C -1.280836 1.355354 -0.358079
C -3.544295 -0.194947 0.277005
C -2.553435 1.968085 -0.302612
C -3.686489 1.184592 0.011636
H 3.383250 1.444352 0.913102
H 2.837250 -1.112650 1.282385
H 3.987834 1.950625 -1.449529
H 3.476432 0.298997 -1.958033
H 2.265198 1.468834 -1.368476
H 5.110962 -0.317702 1.432846
H 5.698009 0.798191 0.167089
H 5.103188 -0.831307 -0.286408
H 0.889045 0.548012 1.261250
H -0.401385 1.951335 -0.629273
H -4.424144 -0.799127 0.534737
H -2.659509 3.037283 -0.511437
H -4.680535 1.642846 0.053787
H -2.926125 -2.618202 0.654903


