%chk=000085725.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085725

0 1
 O    4.285500      7.2499998E-02 -0.5120000    
 N   -3.419700     -0.3056000      0.3750000    
 C   -2.117000      0.1590000     -0.1110000    
 C   -1.128500      0.2384000       1.066700    
 C   0.3204000      0.1941000      0.6440000    
 C   -2.314600       1.507900     -0.8026000    
 C   -4.355800     -0.4489000     -0.7276000    
 C   0.9610000      -1.030300      0.5443000    
 C   0.9820000       1.378800      0.3638000    
 C   -5.710400     -0.9323000     -0.2383000    
 C    2.299600      -1.071200      0.1541000    
 C    2.320600       1.338100     -2.6600000E-02
 C    2.979400      0.1129000     -0.1315000    
 C    4.897200      -1.213600     -0.5982000    
 H   -1.731400     -0.5620000     -0.8444000    
 H   -1.294900     -0.6017000       1.756100    
 H   -1.316100       1.138400       1.668200    
 H   -3.310300      -1.201400      0.8497000    
 H   -1.353800       1.984200      -1.018100    
 H   -2.887500       2.206200     -0.1815000    
 H   -2.806500       1.414800      -1.775900    
 H   -4.554800      0.5012000      -1.231100    
 H   -3.974900      -1.158000      -1.472100    
 H   0.4386000      -1.957500      0.7619000    
 H   0.4839000       2.339600      0.4529000    
 H   -5.629700      -1.911500      0.2456000    
 H   -6.145600     -0.2298000      0.4806000    
 H   -6.405400      -1.029100      -1.078800    
 H    2.749600      -2.056200      9.2399999E-02
 H    2.845700       2.264000     -0.2452000    
 H    4.931300      -1.709300      0.3779000    
 H    5.934100      -1.057800     -0.9138000    
 H    4.420500      -1.835600      -1.363300    


%chk=000085725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085725

0 1
O 4.398498 0.235189 -0.313037
N -3.548705 -0.132467 0.290334
C -2.157083 0.016630 -0.209828
C -1.219332 0.135588 1.029918
C 0.261393 0.132041 0.688119
C -2.036383 1.244364 -1.134759
C -4.578029 -0.468652 -0.719702
C 0.930599 -1.070583 0.354600
C 1.018843 1.334531 0.673884
C -5.928240 -0.755760 -0.039674
C 2.302990 -1.090651 0.014047
C 2.385558 1.339195 0.337677
C 3.032777 0.123662 0.004682
C 5.111492 -0.994850 -0.662384
H -1.834016 -0.886238 -0.792638
H -1.445964 -0.714797 1.707648
H -1.494536 1.059253 1.572976
H -3.581349 -0.806958 1.070298
H -0.985961 1.396880 -1.437958
H -2.393102 2.147594 -0.606485
H -2.637066 1.121907 -2.053587
H -4.695341 0.389745 -1.407244
H -4.283475 -1.346535 -1.350716
H 0.374119 -2.016485 0.367616
H 0.528162 2.280328 0.933161
H -5.857456 -1.626843 0.640669
H -6.250992 0.117056 0.554862
H -6.707464 -0.979012 -0.790369
H 2.784028 -2.042289 -0.232080
H 2.970255 2.264267 0.329206
H 5.109581 -1.715652 0.178751
H 6.143295 -0.678592 -0.875691
H 4.675403 -1.473566 -1.561093


