%chk=000107610.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107610

0 1
 O   -1.201700     -4.0899999E-02  0.5502000    
 O   -6.509300      0.3146000     -0.8457000    
 O   -2.590800       1.619600     -0.2563000    
 N   -4.733600      0.4374000      0.6755000    
 C   -3.505900     -0.2629000      0.9273000    
 C   -3.693900      -1.589200      0.2160000    
 C    3.692500     -0.3140000      0.1469000    
 C    2.446800      0.5232000     -0.1519000    
 C   -4.674700      -1.276200     -0.9137000    
 C    4.993600      0.3395000     -0.3276000    
 C    1.182400     -0.1636000      0.3624000    
 C    6.245500     -0.4619000      3.6100000E-02
 C   -5.455900     -9.7999997E-02 -0.3855000    
 C  -6.7199998E-02  0.6411000      3.4000002E-02
 C   -2.409900      0.5627000      0.3332000    
 C    7.516400      0.2707000     -0.3967000    
 C    8.765600     -0.5020000     -4.3000001E-03
 H   -3.359100     -0.3587000       2.006700    
 H   -2.769800      -2.040100     -0.1579000    
 H   -4.161100      -2.307700      0.9016000    
 H    3.755400     -0.4891000       1.228200    
 H    3.592900      -1.298200     -0.3276000    
 H    2.367500      0.6839000      -1.233800    
 H    2.546200       1.510000      0.3158000    
 H   -5.334400      -2.121300      -1.124700    
 H   -4.150700     -0.9711000      -1.824800    
 H    4.952100      0.4761000      -1.415300    
 H    5.067800       1.341200      0.1142000    
 H    1.245800     -0.3119000       1.447700    
 H    1.090600      -1.166800     -7.2400004E-02
 H    6.202500      -1.447700     -0.4423000    
 H    6.269700     -0.6289000       1.119800    
 H   -5.029000       1.262400       1.188400    
 H  -0.1693000      0.7491000      -1.052200    
 H  -2.4000001E-03   1.636600      0.4889000    
 H    7.550500       1.264000      6.5800004E-02
 H    7.509100      0.4182000      -1.482800    
 H    8.819500     -0.6361000       1.080800    
 H    9.661900      3.8400002E-02 -0.3246000    
 H    8.778800      -1.490600     -0.4741000    


%chk=000107610-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107610

0 1
O -1.228799 0.011796 0.546455
O -6.830437 0.263588 -0.612436
O -2.620842 1.653180 -0.359118
N -4.901313 0.324359 0.745871
C -3.585005 -0.299351 0.860777
C -3.770401 -1.640221 0.060679
C 3.766608 -0.240094 0.254952
C 2.504975 0.571362 -0.116395
C -4.918365 -1.336641 -0.930396
C 5.073921 0.393690 -0.270950
C 1.201380 -0.084249 0.397779
C 6.336904 -0.415219 0.101373
C -5.698488 -0.175397 -0.285039
C -0.028856 0.739778 0.022030
C -2.468137 0.584319 0.270558
C 7.644585 0.212337 -0.432917
C 8.901112 -0.602734 -0.057780
H -3.312052 -0.512914 1.910055
H -2.831043 -1.954262 -0.419579
H -4.073767 -2.431008 0.767723
H 3.825650 -0.341580 1.358664
H 3.671285 -1.270195 -0.147461
H 2.454959 0.683303 -1.219502
H 2.595747 1.597174 0.297565
H -5.590074 -2.191290 -1.106563
H -4.549282 -0.991839 -1.913982
H 5.015317 0.492373 -1.375258
H 5.169081 1.425329 0.128215
H 1.244317 -0.195664 1.498302
H 1.101296 -1.102239 -0.025750
H 6.240969 -1.448926 -0.292495
H 6.401567 -0.508991 1.205816
H -5.145090 1.197060 1.215750
H -0.142050 0.852829 -1.072205
H -0.013059 1.749448 0.472769
H 7.740660 1.244866 -0.039023
H 7.578944 0.306088 -1.536286
H 9.006950 -0.684872 1.040596
H 9.821552 -0.133762 -0.451562
H 8.843682 -1.629631 -0.465931


