%chk=000062458.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062458

0 1
 O   -3.426800     -0.7209000      -2.007600    
 N   -3.116300      0.3343000      7.3799998E-02
 C   -2.649800       1.641500     -0.3349000    
 C   -1.234500       1.938400      0.1519000    
 C   -3.163400     -5.1300000E-02   1.464200    
 C  -0.1689000      0.9402000     -0.3156000    
 C   -4.021300      -1.300500       1.445800    
 C    1.228700       1.242000      0.2296000    
 C   -3.744900      -1.914200      7.8500003E-02
 C    2.249100      0.2124000     -0.2615000    
 C   -3.433600     -0.7149000     -0.7858000    
 C    3.641600      0.4930000      0.3081000    
 C    4.666100     -0.5187000     -0.2102000    
 C    6.073300     -0.2971000      0.3482000    
 C    7.100600      -1.284000     -0.1846000    
 H   -3.347100       2.382600      7.0600003E-02
 H   -2.690500       1.710000      -1.427600    
 H   -1.226500       1.977000       1.248400    
 H  -0.9545000       2.942200     -0.1908000    
 H   -2.148200     -0.2702000       1.809700    
 H   -3.604400      0.7434000       2.072500    
 H  -0.4499000     -7.4199997E-02 -9.8000001E-03
 H  -0.1396000      0.9409000      -1.412400    
 H   -3.799900      -1.981400       2.272400    
 H   -5.081000      -1.023500       1.512600    
 H    1.536000       2.246600     -8.4500000E-02
 H    1.200900       1.239300       1.326000    
 H   -2.866700      -2.566900      0.1030000    
 H   -4.609700      -2.460900     -0.3048000    
 H    1.929000     -0.7941000      3.4200002E-02
 H    2.288500      0.2305000      -1.357500    
 H    3.957300       1.506200      3.1800002E-02
 H    3.606900      0.4517000       1.403400    
 H    4.702900     -0.4659000      -1.305500    
 H    4.336200      -1.533000      4.6399999E-02
 H    6.403300      0.7202000      0.1064000    
 H    6.045300     -0.3703000       1.441900    
 H    8.084900      -1.079100      0.2476000    
 H    7.183800      -1.210800      -1.273500    
 H    6.822800      -2.311600      7.0500001E-02


%chk=000062458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062458

0 1
O -3.212461 -0.670689 -2.009889
N -3.177699 0.340488 0.125197
C -2.665654 1.649697 -0.298971
C -1.230396 1.946984 0.202868
C -3.398303 -0.017295 1.539548
C -0.178302 0.940168 -0.310252
C -4.217775 -1.338659 1.452431
C 1.245064 1.230921 0.214583
C -3.831773 -1.931631 0.073614
C 2.297300 0.216972 -0.288414
C -3.384947 -0.716639 -0.757560
C 3.718236 0.487482 0.254982
C 4.768638 -0.530999 -0.242578
C 6.187964 -0.267018 0.309991
C 7.229653 -1.292416 -0.187649
H -3.357527 2.441158 0.054906
H -2.687424 1.641398 -1.404578
H -1.215931 1.969800 1.312639
H -0.961995 2.970247 -0.129904
H -2.433079 -0.170125 2.066440
H -3.945277 0.787518 2.065941
H -0.476074 -0.086441 -0.013369
H -0.177254 0.946493 -1.418921
H -3.997304 -2.014968 2.294673
H -5.297175 -1.107161 1.473582
H 1.548830 2.254980 -0.088993
H 1.236174 1.227498 1.325450
H -2.981853 -2.637032 0.143811
H -4.655493 -2.457747 -0.434556
H 1.983951 -0.808327 0.000375
H 2.318569 0.231590 -1.397990
H 4.034190 1.511274 -0.036644
H 3.694514 0.475147 1.365224
H 4.799552 -0.514965 -1.352230
H 4.450689 -1.555779 0.043249
H 6.506647 0.755559 0.021094
H 6.154662 -0.279799 1.418788
H 8.236556 -1.077564 0.215485
H 7.298240 -1.282421 -1.291968
H 6.953969 -2.318796 0.120495


