%chk=000030430.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030430

0 1
 O   -1.244200      -1.623200      0.7759000    
 O  -2.8500000E-02   1.981800     -0.7022000    
 N   0.5360000     -0.2062000     -3.7200000E-02
 C  -1.6500000E-02  -1.568500      2.5599999E-02
 C   -1.772300      0.5526000     -0.1344000    
 C  -0.3372000      0.8561000     -0.3226000    
 C   -2.148600     -0.6602000      0.4353000    
 C    1.965400     -1.1700000E-02  5.9900001E-02
 C  -0.2227000      -2.195000      -1.357000    
 C   -2.748900       1.498400     -0.4657000    
 C   -3.492500     -0.9250000      0.7032000    
 C    2.469100       1.212300      0.4903000    
 C    2.828600      -1.050200     -0.2770000    
 C   -4.094900       1.224600     -0.2166000    
 C   -4.465900      1.6400000E-02  0.3716000    
 C    3.848200       1.399400      0.5848000    
 C    4.207600     -0.8632000     -0.1824000    
 C    4.717400      0.3617000      0.2485000    
 H   0.6676000      -2.200000      0.6026000    
 H   0.7024000      -2.237100      -1.937400    
 H  -0.6171000      -3.211800      -1.254500    
 H  -0.9532000      -1.635000      -1.950700    
 H   -2.483700       2.454300     -0.9089000    
 H   -3.788900      -1.865700       1.159300    
 H    1.827500       2.029600      0.8032000    
 H    2.485700      -2.017600     -0.6250000    
 H   -4.853600       1.958300     -0.4730000    
 H   -5.513000     -0.1914000      0.5717000    
 H    4.245500       2.349500      0.9299000    
 H    4.885300      -1.670200     -0.4454000    
 H    5.791000      0.5066000      0.3240000    


%chk=000030430-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030430

0 1
O -1.200811 -1.631674 0.805566
O 0.019761 2.019240 -0.757611
N 0.549746 -0.191541 -0.112057
C 0.012413 -1.577178 -0.043776
C -1.793912 0.515900 -0.211585
C -0.354042 0.858168 -0.413177
C -2.172654 -0.678793 0.455775
C 1.971343 0.006193 0.015939
C -0.293068 -2.177434 -1.427035
C -2.798467 1.454995 -0.554797
C -3.512990 -0.925388 0.816706
C 2.494563 1.237803 0.495768
C 2.871413 -1.047375 -0.300303
C -4.145704 1.208975 -0.228609
C -4.497114 0.023177 0.467941
C 3.884928 1.396975 0.660445
C 4.261860 -0.878625 -0.121796
C 4.779427 0.343521 0.358347
H 0.735795 -2.193012 0.510861
H 0.616361 -2.176978 -2.052509
H -0.649012 -3.215465 -1.314353
H -1.066489 -1.592487 -1.952756
H -2.484572 2.378366 -1.052307
H -3.764096 -1.849200 1.345916
H 1.818425 2.063089 0.722781
H 2.507447 -1.996510 -0.706265
H -4.918469 1.935607 -0.498328
H -5.542923 -0.165186 0.734337
H 4.269964 2.352731 1.032658
H 4.938091 -1.703882 -0.370866
H 5.858386 0.475587 0.490889


