%chk=000027710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027710

0 1
 O   -1.851800      -1.043600      9.8999999E-02
 O   6.1999999E-02   2.308300      -1.193800    
 N    4.442900     -0.2068000     -0.2697000    
 C    4.236800     -0.1221000       1.182900    
 C    5.871900     -0.3038000     -0.5988000    
 C    4.955400       1.092500       1.772300    
 C    6.644000      0.9052000     -6.7699999E-02
 C    6.441600       1.076200       1.433500    
 C    3.711600      -1.345400     -0.8247000    
 C    2.242400      -1.247600     -0.5861000    
 C    1.579600     -3.9500002E-02 -0.8071000    
 C    1.534000      -2.364600     -0.1427000    
 C   0.2028000      4.4100001E-02 -0.5814000    
 C  -0.5040000      -1.069300     -0.1389000    
 C   0.1600000      -2.276800      8.1600003E-02
 C  -0.5221000       1.303900     -0.8066000    
 C   -1.989700       1.293400     -0.5407000    
 C   -2.538300      0.1401000     -0.1088000    
 C   -3.969900      6.6000000E-03  0.1938000    
 C   -2.707700       2.586800     -0.7980000    
 C   -4.861600     -0.3846000     -0.8052000    
 C   -4.437100      0.2694000       1.481500    
 C   -6.220100     -0.5130000     -0.5162000    
 C   -5.795700      0.1410000       1.770300    
 C   -6.687200     -0.2502000      0.7715000    
 H    4.598000      -1.033300       1.678900    
 H    3.179800     -1.2900000E-02   1.447000    
 H    6.000900     -0.3386000      -1.687400    
 H    6.306400      -1.225400     -0.1894000    
 H    4.826300       1.107400       2.860500    
 H    4.501200       2.012800       1.383300    
 H    6.309000       1.811900     -0.5873000    
 H    7.711500      0.7877000     -0.2858000    
 H    6.915500       2.003300       1.774000    
 H    6.929300      0.2500000       1.965200    
 H    4.105300      -2.285200     -0.4141000    
 H    3.861900      -1.390300      -1.911500    
 H    2.126200      0.8286000      -1.166300    
 H    2.038800      -3.311100      3.1800002E-02
 H  -0.3850000      -3.151000      0.4271000    
 H   -2.585700       2.885800      -1.844600    
 H   -2.298800       3.379200     -0.1619000    
 H   -3.781400       2.532300     -0.5991000    
 H   -4.512400     -0.5936000      -1.813500    
 H   -3.754400      0.5745000       2.270900    
 H   -6.914300     -0.8177000      -1.293900    
 H   -6.159400      0.3455000       2.773000    
 H   -7.745000     -0.3502000      0.9964000    


%chk=000027710-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027710

0 1
O -1.986621 -1.002347 -0.063336
O 0.200254 2.524875 -0.424651
N 4.495951 -0.312613 -0.188781
C 4.533996 -0.263283 1.295468
C 5.856985 -0.250943 -0.777434
C 5.227047 1.022858 1.788664
C 6.588189 1.036685 -0.346867
C 6.648629 1.143029 1.194191
C 3.709568 -1.453487 -0.699197
C 2.204899 -1.297686 -0.489358
C 1.597419 -0.028610 -0.470868
C 1.383214 -2.455260 -0.357607
C 0.192623 0.109074 -0.327052
C -0.592660 -1.064343 -0.212383
C -0.011890 -2.350565 -0.224112
C -0.464519 1.439046 -0.310708
C -1.942195 1.441660 -0.171973
C -2.638957 0.250141 -0.031980
C -4.098757 0.048719 0.135206
C -2.605669 2.799984 -0.239442
C -4.721564 -1.088463 -0.452327
C -4.895438 0.945531 0.898535
C -6.106135 -1.305946 -0.302852
C -6.280219 0.721641 1.050517
C -6.893376 -0.399715 0.445977
H 5.076267 -1.157422 1.706139
H 3.496649 -0.305656 1.673285
H 5.761265 -0.282247 -1.879487
H 6.472606 -1.138920 -0.469622
H 5.264932 1.016786 2.894984
H 4.619454 1.894776 1.479013
H 6.041759 1.908557 -0.755321
H 7.606519 1.043003 -0.781215
H 7.117110 2.098052 1.498123
H 7.286218 0.327278 1.594838
H 4.037765 -2.430142 -0.254966
H 3.906750 -1.529534 -1.788307
H 2.209435 0.874389 -0.562226
H 1.849322 -3.448261 -0.357719
H -0.651195 -3.231849 -0.119308
H -1.981165 3.459520 -0.865411
H -2.655149 3.280368 0.756641
H -3.626255 2.749482 -0.652242
H -4.111188 -1.793185 -1.024724
H -4.429659 1.797958 1.400410
H -6.571612 -2.181040 -0.769395
H -6.877821 1.417854 1.648952
H -7.969284 -0.569850 0.563229


