%chk=000160503.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160503

0 1
 O  -0.5970000       2.842700      0.1632000    
 O   -2.991200       2.994500      0.1301000    
 O    5.102600     -0.4283000      7.1999997E-02
 N   -1.597200      -3.226500      0.2224000    
 C  -0.7019000      -2.135400     -0.1902000    
 C   -1.347800     -0.7606000     -9.7499996E-02
 C   0.5644000      -2.182200      0.6792000    
 C  -0.5118000      0.3880000     -4.5299999E-02
 C   -2.763300     -0.6536000     -0.1156000    
 C   -3.624100      -1.892200     -0.1273000    
 C    1.498600      -1.049500      0.3168000    
 C   -2.855400      -3.153400     -0.5177000    
 C   0.9610000      0.2100000     -4.2900000E-02
 C   -1.172600       1.611100      3.6499999E-02
 C   -3.368900      0.6035000     -4.6000000E-02
 C   -2.550500       1.709100      3.1700000E-02
 C    2.885800      -1.252700      0.3703000    
 C    1.868500       1.220300     -0.4049000    
 C    3.758400     -0.2250000      2.9700000E-02
 C   -1.745600       3.707300      0.2040000    
 C    3.250100       1.006600     -0.3658000    
 C    5.937900      0.6665000     -0.3030000    
 H  -0.4167000      -2.295100      -1.240000    
 H    1.068600      -3.146400      0.5352000    
 H   0.3203000      -2.092300       1.746500    
 H   -4.046800      -2.019700      0.8777000    
 H   -4.458800      -1.756700     -0.8254000    
 H   -1.783800      -3.161500       1.223200    
 H   -3.462800      -4.037100     -0.2937000    
 H   -2.660700      -3.172600      -1.597400    
 H   -4.448800      0.7078000     -3.5799999E-02
 H    3.284400      -2.219000      0.6702000    
 H    1.526800       2.194200     -0.7428000    
 H   -1.689100       4.407600     -0.6372000    
 H   -1.721800       4.279100       1.138600    
 H    3.869300       1.847500     -0.6603000    
 H    5.815700       1.516800      0.3765000    
 H    5.786200      0.9475000      -1.350700    
 H    6.975100      0.3286000     -0.2092000    


%chk=000160503-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160503

0 1
O -0.616143 2.925452 -0.071569
O -2.998957 3.083268 -0.064612
O 5.140011 -0.454589 0.056546
N -1.582479 -3.301396 0.182658
C -0.701177 -2.164801 -0.174793
C -1.381393 -0.785457 -0.087313
C 0.573963 -2.185995 0.687551
C -0.526437 0.376419 -0.068828
C -2.795984 -0.679942 -0.081069
C -3.680919 -1.926591 -0.074167
C 1.507210 -1.050158 0.303838
C -2.901770 -3.200442 -0.486953
C 0.947176 0.218391 -0.060471
C -1.190648 1.616030 -0.052614
C -3.424592 0.600706 -0.059474
C -2.595567 1.718504 -0.044362
C 2.900951 -1.224109 0.326353
C 1.833660 1.277375 -0.386664
C 3.769879 -0.154540 -0.003016
C -1.753819 3.841972 0.194338
C 3.233472 1.105270 -0.363289
C 6.080623 0.615253 -0.283300
H -0.393669 -2.316874 -1.232746
H 1.072254 -3.165095 0.578071
H 0.282049 -2.081930 1.756279
H -4.098010 -2.071860 0.944694
H -4.549526 -1.773628 -0.744828
H -1.690677 -3.365315 1.207688
H -3.492312 -4.107265 -0.262379
H -2.717705 -3.190758 -1.578530
H -4.513809 0.700020 -0.058419
H 3.341115 -2.188800 0.599211
H 1.425523 2.252410 -0.663671
H -1.697395 4.692767 -0.500858
H -1.728096 4.147651 1.258877
H 3.882841 1.945714 -0.625189
H 5.978201 1.475877 0.406177
H 5.940486 0.958353 -1.326935
H 7.078769 0.167010 -0.171131


