%chk=000177042.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177042

0 1
 O   0.6542000      -1.101300     -0.5086000    
 O    3.932600     -0.4413000      0.6723000    
 O   -1.515800      0.7015000     -0.9900000    
 O   -2.207300      0.4175000       1.212300    
 O   -4.686100      -1.891500      0.4644000    
 N   -3.634700     -7.2899997E-02 -0.5478000    
 C    1.952900      -1.644600     -0.1482000    
 C    2.779700     -0.4510000      0.2874000    
 C    1.941100      0.7110000      0.1642000    
 C   0.7268000      0.2520000     -0.3025000    
 C    1.769800      -2.627200       1.001600    
 C    2.563000      -2.308500      -1.376300    
 C  -0.3134000       1.131100     -0.5314000    
 C    2.194300       2.041200      0.4276000    
 C  -9.3800001E-02   2.488800     -0.2752000    
 C    1.151300       2.940200      0.2010000    
 C   -2.445500      0.3505000      9.8999999E-03
 C   -4.769200     -0.4952000      0.2394000    
 H    1.319600      -2.133900       1.871000    
 H    1.092600      -3.439700      0.7162000    
 H    2.724800      -3.059900       1.317400    
 H    3.550400      -2.728600      -1.158200    
 H    1.914800      -3.109000      -1.749500    
 H    2.676800      -1.588700      -2.195400    
 H    3.155600       2.381200      0.7940000    
 H  -0.8894000       3.210500     -0.4438000    
 H    1.299600       3.999300      0.3931000    
 H   -3.708900     -0.1052000      -1.559800    
 H   -5.683500     -0.2705000     -0.3160000    
 H   -4.782300      2.1600001E-02   1.202800    
 H   -4.513600      -2.304400     -0.3987000    


%chk=000177042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177042

0 1
O 0.472035 -0.920682 -0.392451
O 4.014127 -0.616244 0.460362
O -1.639629 1.113207 -0.743853
O -2.031883 -0.015684 1.315028
O -4.368162 -2.344870 -0.167173
N -3.578410 -0.035754 -0.468613
C 1.795374 -1.617271 -0.080019
C 2.791807 -0.450445 0.200289
C 2.014776 0.797100 0.103799
C 0.682223 0.441160 -0.225781
C 1.574174 -2.470184 1.178655
C 2.198402 -2.427877 -1.317968
C -0.310261 1.435885 -0.369811
C 2.392944 2.149873 0.266508
C 0.064596 2.781738 -0.210199
C 1.406894 3.142366 0.099074
C -2.394573 0.287775 0.164459
C -4.559244 -0.926826 0.140316
H 1.183676 -1.856250 2.007706
H 0.850014 -3.275833 0.970780
H 2.536864 -2.914090 1.488144
H 3.191926 -2.877500 -1.144787
H 1.465013 -3.230364 -1.505182
H 2.257803 -1.785004 -2.212789
H 3.428540 2.400748 0.516352
H -0.706127 3.550626 -0.327585
H 1.660747 4.200415 0.215157
H -3.697970 0.302341 -1.424906
H -5.568910 -0.585580 -0.162571
H -4.444979 -0.870630 1.232162
H -4.525390 -2.509147 -1.131903


