%chk=000178582.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178582

0 1
 O    8.414400      0.6341000      -1.170700    
 N    8.890300       1.351200      0.9632000    
 C   -2.973500     -0.5318000      0.1841000    
 C   -1.632800     -0.1504000     -0.4512000    
 C   -4.215000      0.1240000     -0.4284000    
 C  -0.4261000     -0.7915000      0.2384000    
 C   -5.516700     -0.2455000      0.2873000    
 C   0.8865000     -0.3053000     -0.3818000    
 C   -6.718300      0.4451000     -0.3624000    
 C    2.129600     -0.9401000      0.2504000    
 C   -8.049000      0.1287000      0.3273000    
 C    3.443500     -0.3978000     -0.3225000    
 C   -9.289400      0.7758000     -0.2932000    
 C    4.688400      -1.038500      0.3021000    
 C   -10.57330      0.4804000      0.4658000    
 C    5.976500     -0.4533000     -0.2048000    
 C    6.852900      0.1847000      0.5828000    
 C    8.112000      0.7302000      1.3500000E-02
 H   -3.089600      -1.621800      0.1327000    
 H   -2.937200     -0.2761000       1.250900    
 H   -1.643700     -0.4374000      -1.509800    
 H   -1.528300      0.9414000     -0.4208000    
 H   -4.087500       1.213400     -0.4055000    
 H   -4.284100     -0.1640000      -1.484600    
 H  -0.4374000     -0.5454000       1.306900    
 H  -0.4935000      -1.882800      0.1561000    
 H   -5.656700      -1.332500      0.2593000    
 H   -5.451500      4.6200000E-02   1.342200    
 H   0.8836000     -0.5222000      -1.457100    
 H   0.9500000      0.7851000     -0.2789000    
 H   -6.563600       1.531100     -0.3523000    
 H   -6.783400      0.1445000      -1.415500    
 H    2.092200      -2.026600      0.1050000    
 H    2.111900     -0.7639000       1.332900    
 H   -7.978800      0.4403000       1.377500    
 H   -8.190500     -0.9595000      0.3377000    
 H    3.457900     -0.5595000      -1.407900    
 H    3.477800      0.6881000     -0.1664000    
 H   -9.146300       1.862100     -0.3354000    
 H   -9.397700      0.4295000      -1.327800    
 H    4.689900      -2.113400      8.4100001E-02
 H    4.630800     -0.9436000       1.393700    
 H   -10.76750     -0.5962000      0.4994000    
 H   -10.51300      0.8509000       1.494000    
 H   -11.42410      0.9656000     -2.2299999E-02
 H    6.176200     -0.5805000      -1.265700    
 H    6.662800      0.3131000       1.643200    
 H    9.779700       1.769700      0.7110000    
 H    8.620900       1.420300       1.939600    


%chk=000178582-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178582

0 1
O 8.451564 0.202694 -1.521315
N 9.285202 1.013471 0.487954
C -3.014652 -0.394820 0.334865
C -1.670888 0.115317 -0.232742
C -4.246109 0.303012 -0.285253
C -0.439300 -0.581462 0.388213
C -5.590519 -0.211196 0.277163
C 0.903457 -0.076776 -0.186934
C -6.821502 0.485970 -0.344911
C 2.134756 -0.769568 0.438893
C -8.166887 -0.031211 0.212549
C 3.473860 -0.277320 -0.153836
C -9.397351 0.665393 -0.412294
C 4.705984 -0.967162 0.496981
C -10.737204 0.140989 0.148081
C 6.004205 -0.559026 -0.150614
C 7.052464 0.040939 0.475520
C 8.291095 0.410857 -0.278192
H -3.090783 -1.489688 0.166487
H -3.026842 -0.248857 1.435510
H -1.658912 -0.032350 -1.333073
H -1.595244 1.210419 -0.066168
H -4.172181 1.397516 -0.113732
H -4.231676 0.160284 -1.386268
H -0.448115 -0.428794 1.487927
H -0.517930 -1.677070 0.226343
H -5.664046 -1.305753 0.105708
H -5.606181 -0.068221 1.378132
H 0.913378 -0.234848 -1.285666
H 0.980175 1.019565 -0.030650
H -6.749776 1.580299 -0.170965
H -6.803729 0.345506 -1.446222
H 2.052010 -1.867276 0.293426
H 2.132501 -0.600204 1.536059
H -8.187513 0.110105 1.313706
H -8.239718 -1.125590 0.039207
H 3.485344 -0.464997 -1.246886
H 3.560916 0.819759 -0.023633
H -9.324380 1.758471 -0.237500
H -9.374585 0.525099 -1.512484
H 4.577839 -2.065871 0.391556
H 4.726195 -0.748243 1.582386
H -10.847016 -0.944011 -0.039317
H -10.798106 0.299052 1.241601
H -11.600358 0.653166 -0.315841
H 6.115938 -0.750972 -1.229564
H 7.007171 0.264223 1.551207
H 10.151642 1.286744 0.025797
H 9.175107 1.188338 1.484889


