%chk=000156236.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156236

0 1
 O  -0.5043000       3.903400     -8.9999998E-04
 N   -5.369300      -1.478300     -2.4000001E-03
 C    3.439900      -1.225600     -6.0000003E-04
 C    2.308700     -0.1841000      3.0000001E-04
 C    4.315400      -1.042500       1.258000    
 C    4.315200      -1.041400      -1.259200    
 C    2.942300      -2.688900     -1.3000000E-03
 C    1.011300     -0.6311000      1.1000000E-03
 C  -1.4500000E-02  0.3141000      1.6000000E-03
 C    2.648400       1.145600     -1.9999999E-04
 C   0.2911000       1.675100      1.1000000E-03
 C    1.622500       2.090700      1.9999999E-04
 C   -1.389400     -0.1470000      1.0000000E-03
 C   -2.047800     -0.3685000       1.208700    
 C   -2.047300     -0.3661000      -1.207200    
 C  -0.7502000       2.696400      9.9999997E-05
 C   -3.370400     -0.8112000       1.208000    
 C   -3.370000     -0.8089000      -1.207900    
 C   -4.031500      -1.031600     -3.0000001E-04
 H    5.104900      -1.802000       1.303200    
 H    4.812200     -6.6600002E-02   1.283600    
 H    3.716000      -1.131100       2.171900    
 H    4.812300     -6.5499999E-02  -1.283800    
 H    5.104300      -1.801100      -1.305400    
 H    3.715500      -1.128600      -2.173000    
 H    3.789100      -3.386700     -2.2000000E-03
 H    2.348300      -2.921600      0.8904000    
 H    2.347400      -2.920300     -0.8928000    
 H   0.7360000      -1.679100      1.3000000E-03
 H    3.676200       1.491800     -7.9999998E-04
 H    1.889100       3.144500     -3.9999999E-04
 H   -1.546600     -0.2010000       2.159000    
 H   -1.545800     -0.1969000      -2.157200    
 H   -1.801700       2.371200      1.2000001E-03
 H   -3.875300     -0.9808000       2.155600    
 H   -3.874400     -0.9766000      -2.156100    
 H   -5.847900      -1.639800     -0.8786000    
 H   -5.849600      -1.642000      0.8725000    


%chk=000156236-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156236

0 1
O -0.475471 4.058666 -0.001359
N -5.464870 -1.563293 -0.000955
C 3.520175 -1.271721 -0.000021
C 2.383642 -0.224408 -0.000144
C 4.400354 -1.072267 1.271995
C 4.400202 -1.072854 -1.272230
C 2.987150 -2.726890 0.000340
C 1.013020 -0.584967 -0.000133
C -0.028703 0.377238 -0.000201
C 2.701118 1.166918 -0.000275
C 0.317970 1.762376 -0.000208
C 1.690755 2.137431 -0.000325
C -1.455964 -0.095585 -0.000316
C -2.143271 -0.352955 1.214814
C -2.145712 -0.345259 -1.215679
C -0.725079 2.818984 0.000170
C -3.465801 -0.836473 1.222892
C -3.468219 -0.828824 -1.224181
C -4.154228 -1.083672 -0.000753
H 5.227092 -1.807057 1.280440
H 4.844385 -0.061851 1.309153
H 3.802080 -1.213559 2.190568
H 4.844302 -0.062488 -1.309887
H 5.226897 -1.807697 -1.280472
H 3.801806 -1.214506 -2.190668
H 3.838345 -3.431747 0.000340
H 2.376420 -2.939136 0.896975
H 2.376126 -2.939469 -0.896016
H 0.725249 -1.640216 -0.000174
H 3.749513 1.487128 -0.000312
H 1.925166 3.208012 -0.000335
H -1.633737 -0.168928 2.167973
H -1.638040 -0.155266 -2.168661
H -1.777809 2.452631 -0.000416
H -3.972391 -1.023008 2.177942
H -3.976666 -1.009451 -2.179378
H -5.958730 -1.731208 -0.872251
H -5.956973 -1.736732 0.870253


