%chk=000227426.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227426

0 1
 O    1.237500       2.401800      0.8727000    
 O   0.2122000      0.6358000      -2.445200    
 O   0.3985000      0.9082000       2.349300    
 O  -0.5531000       2.393900      -1.243100    
 N   -1.006200     -0.3075000      0.2891000    
 C    1.321900     -0.5844000     -0.3406000    
 C   0.2201000      0.4174000     -4.2599998E-02
 C    2.680500      6.8099998E-02 -0.5760000    
 C    1.610500      -1.525400      0.8247000    
 C    3.676800      -1.072800     -0.3932000    
 C    2.983400      -2.104000      0.4988000    
 C   -2.083500      0.6329000      0.6280000    
 C   -1.399100      -1.188000     -0.8201000    
 C   -3.359900     -0.1101000       1.025200    
 C   -2.653100      -1.990700     -0.4702000    
 C   -3.803500      -1.074700     -6.8800002E-02
 C   0.6070000       1.239400       1.188200    
 C  -9.0000004E-02   1.260100      -1.276000    
 H    1.139400      -1.190000      -1.236900    
 H    2.926000      0.8362000      0.1620000    
 H    2.771900      0.5223000      -1.567500    
 H   0.8642000      -2.319400      0.9283000    
 H    1.688100      -1.017500       1.789200    
 H    4.613600     -0.7181000      4.8599999E-02
 H    3.922100      -1.525000      -1.361100    
 H    2.878900      -3.051200     -4.3099999E-02
 H    3.558600      -2.308700       1.407400    
 H   -2.358500       1.280000     -0.2120000    
 H   -1.834300       1.287300       1.468700    
 H  -0.6489000      -1.946400      -1.054100    
 H   -1.634500     -0.6432000      -1.740400    
 H   -4.161500      0.6093000       1.228300    
 H   -3.186600     -0.6662000       1.955400    
 H   -2.430300      -2.679700      0.3547000    
 H   -2.953600      -2.605400      -1.326600    
 H   -4.655300      -1.670200      0.2776000    
 H   -4.141900     -0.5062000     -0.9437000    
 H    1.485400       2.911300       1.673300    
 H   9.9999998E-03   1.198700      -3.222600    


%chk=000227426-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227426

0 1
O 1.403896 2.398501 0.857719
O 0.463753 0.992453 -2.543540
O 0.334125 0.960104 2.316510
O -0.614018 2.584274 -1.251982
N -1.079535 -0.175652 0.078518
C 1.375301 -0.530403 -0.411707
C 0.230597 0.513812 -0.140968
C 2.823423 0.022606 -0.527710
C 1.462572 -1.669880 0.655408
C 3.673309 -1.263885 -0.402724
C 2.979291 -2.045981 0.748652
C -2.216121 0.683873 0.521380
C -1.515367 -1.140048 -0.969398
C -3.335811 -0.190535 1.124846
C -2.618526 -2.065260 -0.411717
C -3.820575 -1.247197 0.108460
C 0.607349 1.287300 1.143989
C 0.029300 1.511937 -1.309739
H 1.150052 -0.973235 -1.398829
H 3.064404 0.708849 0.304114
H 2.986202 0.569956 -1.471732
H 0.845951 -2.535196 0.353992
H 1.068752 -1.332237 1.628787
H 4.738009 -1.053038 -0.196586
H 3.624726 -1.841603 -1.346637
H 3.147698 -3.135226 0.675084
H 3.391180 -1.718921 1.721864
H -2.624585 1.280593 -0.329130
H -1.856552 1.396594 1.279490
H -0.658698 -1.749672 -1.294741
H -1.907730 -0.609126 -1.872473
H -4.171922 0.464340 1.437197
H -2.943568 -0.691500 2.030126
H -2.192416 -2.665595 0.415112
H -2.935831 -2.765946 -1.208427
H -4.573735 -1.914329 0.568438
H -4.316322 -0.738331 -0.744375
H 1.648754 2.851074 1.710529
H 0.185464 1.624432 -3.262100


