%chk=000079669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079669

0 1
 O  -0.7695000      -2.073900     -0.7490000    
 O    6.018100       1.399400      0.5128000    
 O   -1.312200       1.874000     -0.7225000    
 N   -2.251200     -0.1265000      6.5800004E-02
 C    2.532600      0.3661000     -1.0600000E-02
 C    2.704500      -1.022400     -0.2227000    
 C   0.1314000      0.1001000     -0.2977000    
 C    1.239100      0.9119000     -5.1399998E-02
 C    1.578400      -1.824300     -0.4697000    
 C   0.3006000      -1.265400     -0.5065000    
 C    3.658800       1.168000      0.2364000    
 C    3.998000      -1.568200     -0.1824000    
 C   -1.194300      0.7023000     -0.3325000    
 C   -3.635100      0.1722000      0.1119000    
 C    4.936400      0.6086000      0.2735000    
 C    5.105700     -0.7568000      6.4400002E-02
 C   -4.540300     -0.7855000      0.5380000    
 C   -4.050800       1.435400     -0.2776000    
 C   -5.899000     -0.4718000      0.5761000    
 C   -4.103500      -2.150900      0.9603000    
 C   -5.409400       1.749000     -0.2394000    
 C   -6.333500      0.7954000      0.1874000    
 C    7.295000      0.7634000      0.5355000    
 H    1.105800       1.979300      0.1181000    
 H    1.702800      -2.893300     -0.6341000    
 H    3.544000       2.237800      0.4016000    
 H    4.152900      -2.633300     -0.3431000    
 H   -2.005700      -1.059200      0.3836000    
 H    6.068600      -1.256000      7.9099998E-02
 H   -3.406600       2.230400     -0.6199000    
 H   -6.632800      -1.202400      0.9058000    
 H   -3.614600      -2.672500      0.1309000    
 H   -3.418200      -2.091000       1.812300    
 H   -4.952100      -2.769200       1.273700    
 H   -5.749400       2.735400     -0.5418000    
 H   -7.391300       1.039800      0.2170000    
 H  -0.4590000      -2.988200     -0.8651000    
 H    7.545200      0.3280000     -0.4378000    
 H    7.366400      3.2600001E-02   1.348200    
 H    8.039400       1.540400      0.7386000    


%chk=000079669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079669

0 1
O -0.784207 -2.312580 0.132184
O 6.082211 1.535267 0.040894
O -1.241667 1.945769 0.076356
N -2.336040 -0.134417 0.112003
C 2.601314 0.271434 0.077072
C 2.794173 -1.165509 0.095699
C 0.134581 -0.043060 0.095716
C 1.266405 0.782679 0.077850
C 1.640950 -2.011959 0.114023
C 0.356857 -1.469461 0.113757
C 3.738635 1.133994 0.058782
C 4.129053 -1.677262 0.095217
C -1.204546 0.673112 0.093865
C -3.701206 0.265385 0.115602
C 5.034108 0.601213 0.058961
C 5.232476 -0.819502 0.077355
C -4.687414 -0.775706 0.135692
C -4.103944 1.629015 0.100419
C -6.052395 -0.410519 0.139872
C -4.286123 -2.242095 0.152491
C -5.475733 1.957069 0.105125
C -6.458602 0.943548 0.124811
C 7.456334 1.028076 0.038916
H 1.084382 1.863098 0.064301
H 1.780049 -3.101820 0.128456
H 3.610245 2.220794 0.044599
H 4.287126 -2.762044 0.109201
H -2.145163 -1.146007 0.124742
H 6.242779 -1.239210 0.077520
H -3.336570 2.404232 0.085368
H -6.808779 -1.204659 0.155330
H -3.691111 -2.519804 -0.740264
H -3.679696 -2.496211 1.044590
H -5.179941 -2.887538 0.166815
H -5.772062 3.011985 0.093225
H -7.523782 1.199078 0.128388
H -0.531431 -3.266763 0.138087
H 7.661313 0.414371 -0.859995
H 7.672487 0.437959 0.950915
H 8.090136 1.926751 0.023260


