%chk=000149320.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149320

0 1
 O   -5.272000      -1.832700     -0.5589000    
 O   -5.547900      0.9058000     -0.4517000    
 N   -2.220400     -0.1789000      0.7216000    
 C   -3.648800     -0.3133000      0.4810000    
 C  -1.5100000E-02  6.8099998E-02 -0.3299000    
 C   0.7606000      -1.071100     -0.2559000    
 C   -1.489400     -8.1799999E-02 -0.5405000    
 C    2.108700     -0.9575000     -6.2899999E-02
 C   0.6030000       1.331300     -0.2043000    
 C    2.807200      0.2438000      7.1999997E-02
 C    2.018800       1.439300     -2.2000000E-03
 C    2.658700      -2.214000     -2.4499999E-02
 C   -3.886200      -1.598800     -0.3371000    
 C   -4.140600      0.9509000     -0.2497000    
 C   -4.349200     -0.4064000       1.845200    
 C   0.4371000      -2.488300     -0.3451000    
 C    1.582300      -3.178000     -0.2057000    
 C    4.204000      8.2699999E-02  0.2631000    
 C  -0.1757000       2.496300     -0.2777000    
 C    4.018600      -2.360300      0.1617000    
 C    2.572900       2.731100      0.1149000    
 C    4.792300      -1.200600      0.3061000    
 C   0.4054000       3.757500     -0.1576000    
 C    1.775800       3.874700      3.7900001E-02
 H   -1.819900      0.7170000      -1.204600    
 H   -1.612000     -0.9796000      -1.152300    
 H   -1.880200     -0.9828000       1.249700    
 H   -3.466300      -2.483700      0.1558000    
 H   -3.468000      -1.543400      -1.344300    
 H   -3.919400       1.856000      0.3275000    
 H   -3.721200       1.080400      -1.249200    
 H   -4.022100      -1.294000       2.400100    
 H   -5.438600     -0.4646000       1.749100    
 H   -4.126900      0.4699000       2.466400    
 H  -0.5458000      -2.904400     -0.4897000    
 H    1.706100      -4.247900     -0.2185000    
 H    4.851100      0.9481000      0.3805000    
 H   -1.253300       2.483600     -0.4062000    
 H    4.483800      -3.339500      0.1967000    
 H    3.640400       2.868700      0.2691000    
 H    5.865900      -1.288400      0.4539000    
 H  -0.2135000       4.648400     -0.2118000    
 H    2.228700       4.857400      0.1328000    
 H   -5.661200      -2.123400      0.2828000    
 H   -5.738300      0.1637000      -1.049900    


%chk=000149320-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149320

0 1
O -5.696434 -1.681459 -0.347396
O -5.755125 1.087302 -0.515595
N -2.283626 -0.104843 0.468409
C -3.768752 -0.177076 0.395419
C 0.027093 -0.162047 -0.419196
C 0.887296 -1.258080 -0.380700
C -1.450666 -0.352811 -0.736158
C 2.290103 -1.051752 -0.108593
C 0.592057 1.170718 -0.167897
C 2.896358 0.194256 0.116823
C 2.012154 1.363231 0.083870
C 2.975353 -2.305004 -0.120787
C -4.223048 -1.533678 -0.240561
C -4.294999 1.018410 -0.458710
C -4.308183 -0.057464 1.837979
C 0.718767 -2.716980 -0.565340
C 1.953494 -3.334961 -0.408963
C 4.311081 0.169183 0.353922
C -0.255257 2.323524 -0.178940
C 4.359533 -2.310109 0.114189
C 2.502963 2.684966 0.286887
C 5.009210 -1.055709 0.351087
C 0.256881 3.611937 0.023623
C 1.647737 3.796032 0.254740
H -1.753853 0.359100 -1.527210
H -1.577755 -1.371404 -1.164960
H -1.905687 -0.574474 1.300242
H -3.791876 -2.377882 0.338097
H -3.879079 -1.606998 -1.286247
H -3.962437 1.962136 0.005695
H -3.872377 0.959785 -1.486315
H -4.084232 -0.965258 2.432763
H -5.397796 0.119439 1.835171
H -3.834655 0.807193 2.335248
H -0.221463 -3.225383 -0.787473
H 2.147907 -4.406998 -0.486430
H 4.866514 1.094418 0.539900
H -1.330713 2.182971 -0.313094
H 4.943759 -3.237110 0.117867
H 3.571618 2.837316 0.470273
H 6.089557 -1.048290 0.535592
H -0.414824 4.477054 0.010933
H 2.049229 4.803055 0.412343
H -6.072292 -1.834718 0.555934
H -6.084138 0.169766 -0.738740


