%chk=000153251.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153251

0 1
 O  -0.5067000       2.659600      7.5999998E-02
 O    1.977600       3.570500      7.2999999E-02
 O   -4.686900      0.7238000     -3.1300001E-02
 N    2.287400      -2.819400     -1.9600000E-02
 C    1.340100     -0.5637000     -3.8000001E-03
 C    2.644200     -1.1900000E-02 -3.7000000E-03
 C    1.171100      -1.971100     -3.4000002E-02
 C    3.839700     -0.9253000     -9.4200000E-02
 C    3.521600      -2.271900      0.5370000    
 C   0.2124000      0.3082000      1.0100000E-02
 C   -1.112500     -0.2434000     -2.1800000E-02
 C  -0.1380000      -2.475400     -8.8200003E-02
 C   -1.266800      -1.646900     -7.7500001E-02
 C   0.4677000       1.701800      4.5400001E-02
 C    2.847600       1.370700      1.2100000E-02
 C    1.760200       2.225000      4.6999998E-02
 C    2.153200      -4.266300     -9.0899996E-02
 C   -2.304700      0.5273000     -7.8999996E-03
 C   -2.548900      -2.224600     -0.1181000    
 C   -3.572800     -5.8100000E-02 -4.7400001E-02
 C   -3.695000      -1.436500     -0.1033000    
 C  -0.5142000       3.534500       1.199800    
 C    2.071900       4.235300      -1.184900    
 C   -5.948100      5.7900000E-02 -7.4000001E-02
 H    4.099900      -1.052200      -1.152400    
 H    4.703500     -0.4848000      0.4169000    
 H    4.364500      -2.950600      0.3609000    
 H    3.413800      -2.172100       1.625300    
 H  -0.2994000      -3.552300     -0.1206000    
 H    3.856600       1.775300     -2.6000000E-03
 H    3.132400      -4.748100     -0.1880000    
 H    1.571300      -4.567500     -0.9687000    
 H    1.678500      -4.659600      0.8145000    
 H   -2.322200       1.606200      2.7200000E-02
 H   -2.665200      -3.306400     -0.1608000    
 H   -4.641900      -1.963600     -0.1365000    
 H   7.7000000E-02   3.159100       2.043000    
 H   -1.550200       3.631500       1.539700    
 H  -0.1728000       4.530400      0.9034000    
 H    1.155000       4.098100      -1.766800    
 H    2.933400       3.864900      -1.749300    
 H    2.209800       5.303700     -0.9977000    
 H   -6.077600     -0.4995000      -1.008000    
 H   -6.722700      0.8315000     -5.3700000E-02
 H   -6.101500     -0.5710000      0.8095000    


%chk=000153251-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000153251

0 1
O -0.468013 2.702648 0.097123
O 2.184355 3.614169 -0.046504
O -4.615334 0.860554 -0.239728
N 2.362416 -2.868097 0.007631
C 1.433287 -0.566975 -0.064525
C 2.766415 -0.044427 -0.142585
C 1.234921 -2.021903 -0.005119
C 3.940462 -1.002421 -0.251695
C 3.642943 -2.312944 0.489293
C 0.291054 0.328366 -0.044976
C -1.071793 -0.232647 -0.058136
C -0.061950 -2.529129 0.036483
C -1.212555 -1.671678 -0.013229
C 0.571271 1.740150 -0.012612
C 2.985292 1.337548 -0.166448
C 1.894138 2.231081 -0.102325
C 2.165672 -4.314048 0.137380
C -2.258802 0.552401 -0.145455
C -2.520571 -2.242879 -0.016285
C -3.532377 -0.041416 -0.153017
C -3.676655 -1.455488 -0.078769
C -0.575391 3.295412 1.451507
C 1.640172 4.424953 -1.160608
C -5.961680 0.292302 -0.273180
H 4.130146 -1.237321 -1.318454
H 4.857510 -0.536264 0.152371
H 4.438931 -3.053610 0.293503
H 3.614931 -2.127951 1.588297
H -0.239824 -3.605473 0.110502
H 3.996223 1.753205 -0.230646
H 3.140970 -4.820650 0.044900
H 1.510815 -4.688987 -0.670650
H 1.710739 -4.608128 1.110675
H -2.190307 1.636265 -0.225660
H -2.613659 -3.334670 0.025405
H -4.662137 -1.930528 -0.079886
H -0.823640 2.511761 2.191699
H -1.395687 4.027203 1.390428
H 0.370214 3.797647 1.724208
H 0.541412 4.335141 -1.210577
H 2.091744 4.103057 -2.118658
H 1.937130 5.461331 -0.937361
H -6.104812 -0.366519 -1.152815
H -6.637551 1.157458 -0.347897
H -6.188123 -0.275398 0.651494


