%chk=000153898.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153898

0 1
 O   -5.867200      -2.481300     -0.5099000    
 O   -7.004200      2.6500000E-02 -0.4409000    
 N    2.313300       2.470800      7.3700003E-02
 N   -3.491700      8.7700002E-02  0.6904000    
 C   -4.804000     -0.5015000      0.4772000    
 C   0.9185000      0.7490000     -0.1639000    
 C    2.266500      0.2335000     -4.4700000E-02
 C   0.9929000       2.141800     -8.5400000E-02
 C    3.100700       1.346700      0.1016000    
 C   -1.496400       1.002100     -0.4111000    
 C   -2.844500      0.3854000     -0.5878000    
 C  -0.3653000      0.1790000     -0.3311000    
 C    2.881100      -1.066800     -4.4399999E-02
 C   -4.626700      -1.811800     -0.3163000    
 C   -5.683200      0.5237000     -0.2644000    
 C  -0.1269000       2.979600     -0.1636000    
 C   -5.421800     -0.7857000       1.854800    
 C   -1.376900       2.383800     -0.3282000    
 C    4.293400      -1.162000      0.1033000    
 C    4.487000       1.259000      0.2467000    
 C    2.812300       3.827000      0.1958000    
 C    5.066700     -7.4000000E-03  0.2454000    
 C    2.141100      -2.261300     -0.1853000    
 C    4.907600      -2.424300      0.1052000    
 C    2.774100      -3.506000     -0.1808000    
 C    4.153400      -3.587600     -3.6100000E-02
 H   -3.414000       1.089300      -1.200900    
 H   -2.683800     -0.5027000      -1.205300    
 H   -2.905400     -0.5551000       1.223400    
 H  -0.4929000     -0.8958000     -0.3959000    
 H   -3.951500      -2.501600      0.2035000    
 H   -4.247900      -1.649600      -1.327600    
 H   -5.747500       1.468200      0.2888000    
 H   -5.331900      0.7370000      -1.276300    
 H  -4.4700000E-02   4.059700     -0.1056000    
 H   -4.803300      -1.484200       2.431400    
 H   -6.419500      -1.230300       1.771800    
 H   -5.520000      0.1327000       2.446100    
 H   -2.256600       3.020200     -0.3893000    
 H    5.112100       2.139400      0.3526000    
 H    3.673800       3.842100      0.8674000    
 H    3.094500       4.174100     -0.8012000    
 H    2.042700       4.472900      0.6230000    
 H    6.147600     -7.7900000E-02  0.3572000    
 H    1.064700      -2.254300     -0.3014000    
 H    5.986400      -2.515000      0.2171000    
 H    2.185500      -4.412500     -0.2909000    
 H    4.644000      -4.556500     -3.2800000E-02
 H   -5.678000      -3.301700     -0.9965000    
 H   -7.513700      0.7196000     -0.8945000    


%chk=000153898-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153898

0 1
O -6.749731 -2.020889 -0.160364
O -7.144126 0.519399 -0.980257
N 2.316327 2.420056 0.301559
N -3.699955 0.104258 0.559329
C -5.138405 -0.215368 0.370830
C 1.080149 0.499147 -0.076260
C 2.494564 0.140125 -0.062190
C 1.012580 1.919760 0.158746
C 3.219376 1.350122 0.177667
C -1.371697 0.475493 -0.206097
C -2.680788 -0.275302 -0.442286
C -0.138170 -0.208374 -0.255982
C 3.218290 -1.094005 -0.231925
C -5.321949 -1.745187 0.132923
C -5.690206 0.588314 -0.851084
C -0.214065 2.616061 0.225480
C -5.880128 0.213415 1.654730
C -1.399354 1.880736 0.040757
C 4.668692 -1.049642 -0.147659
C 4.640070 1.391397 0.264035
C 2.644739 3.819345 0.565545
C 5.342138 0.199218 0.100485
C 2.597395 -2.361606 -0.478684
C 5.419724 -2.257417 -0.312083
C 3.358744 -3.525599 -0.635417
C 4.783124 -3.478506 -0.552293
H -3.077900 -0.014873 -1.442868
H -2.455449 -1.369225 -0.471561
H -3.380692 -0.035879 1.524702
H -0.141952 -1.288188 -0.435808
H -5.005307 -2.299824 1.041084
H -4.700695 -2.068603 -0.728076
H -5.438858 1.652615 -0.708483
H -5.204002 0.232534 -1.787633
H -0.250735 3.693270 0.418882
H -5.492590 -0.338752 2.533595
H -6.959477 0.016146 1.564811
H -5.735595 1.294301 1.825990
H -2.375239 2.373627 0.100700
H 5.173385 2.327403 0.458178
H 3.716167 3.992996 0.382213
H 2.073301 4.480028 -0.110736
H 2.416827 4.101828 1.611296
H 6.436727 0.197668 0.161881
H 1.508895 -2.425218 -0.547376
H 6.513610 -2.208805 -0.246384
H 2.858283 -4.482121 -0.824114
H 5.369379 -4.395342 -0.676809
H -6.885550 -2.978332 -0.363225
H -7.389471 -0.444305 -0.875470


