%chk=000160603.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160603

0 1
 O    2.750700       1.464100     -0.5347000    
 O    3.511900     -0.3878000      0.5295000    
 O   -3.980100     -0.6383000     -0.5311000    
 N    1.216200      -1.778300      5.9900001E-02
 C   0.1113000      0.4396000      0.2521000    
 C   -1.306200     -6.1600000E-02 -6.6399999E-02
 C    1.246000     -0.3830000     -0.3785000    
 C   -2.392700      0.8252000      0.5382000    
 C    2.616100      0.1944000     -6.8300001E-02
 C   -3.773200      0.3259000      0.1994000    
 H   0.2444000      0.4703000       1.342100    
 H   0.1929000       1.480500     -8.6499996E-02
 H   -1.435300      -1.082900      0.3111000    
 H   -1.431900     -0.1095000      -1.155400    
 H    1.144000     -0.3790000      -1.470400    
 H   -2.307300       1.850800      0.1644000    
 H   -2.303700      0.8471000       1.629400    
 H   0.3583000      -2.225600     -0.2589000    
 H    1.194900      -1.819300       1.078300    
 H   -4.608000      0.8941000      0.6433000    
 H    3.635700       1.835600     -0.3321000    


%chk=000160603-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160603

0 1
O 2.822598 1.373687 -0.716136
O 3.346933 -0.231945 0.877740
O -4.127767 -0.665344 -0.460384
N 1.244528 -1.815543 -0.000570
C 0.086005 0.464476 0.290478
C -1.320440 -0.034235 -0.098760
C 1.218541 -0.404544 -0.373935
C -2.435321 0.834327 0.511540
C 2.564106 0.202807 0.004598
C -3.845320 0.358869 0.206128
H 0.211350 0.429060 1.391764
H 0.213952 1.517376 -0.030623
H -1.465490 -1.079738 0.234408
H -1.428614 -0.043182 -1.201007
H 1.102788 -0.303016 -1.471190
H -2.358342 1.889728 0.169929
H -2.339743 0.889207 1.618651
H 0.388607 -2.347778 -0.147368
H 1.776329 -2.037613 0.842916
H -4.659073 1.003743 0.631450
H 3.688373 1.761959 -0.414227


