%chk=000226659.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226659

0 1
 O  -0.3317000     -0.9225000      -1.947100    
 O    2.292200      -3.436200      0.9859000    
 O   -4.692700     -0.2421000      0.1849000    
 O   -3.778100       1.835400     -0.2277000    
 N   0.9466000      -2.208600     -0.4832000    
 C   0.1689000      7.8199998E-02  0.1947000    
 C   0.1505000     -0.5750000       1.588700    
 C   -1.165700      0.8374000     -9.9999997E-05
 C   0.2088000      -1.055600     -0.8445000    
 C    1.399900      -1.402700       1.811800    
 C    1.323400       1.082000      2.5599999E-02
 C   -2.355000     -9.0800002E-02  0.1963000    
 C    1.581800      -2.456400      0.7483000    
 C    2.254700      0.8968000     -0.9906000    
 C    1.426500       2.166300      0.8906000    
 C    1.057700      -3.235000      -1.515400    
 C   -3.664900      0.6431000      2.1100000E-02
 C    3.301200       1.806400      -1.143700    
 C    2.472700       3.076100      0.7375000    
 C    3.410000       2.896100     -0.2797000    
 C   -6.006900      0.3074000      4.6599999E-02
 H  -0.6808000      -1.278100       1.703200    
 H   5.3500000E-02  0.1679000       2.388700    
 H   -1.210500       1.294600     -0.9985000    
 H   -1.254900       1.669300      0.7106000    
 H    1.326800      -1.909400       2.781400    
 H    2.300600     -0.7803000       1.835100    
 H   -2.402000     -0.4753000       1.218600    
 H   -2.355600     -0.9270000     -0.5079000    
 H    2.214200      6.8400003E-02  -1.689200    
 H   0.7138000       2.326300       1.694000    
 H    1.569400      -4.132400      -1.160200    
 H    1.608900      -2.816400      -2.363800    
 H   5.4000001E-02  -3.507200      -1.857700    
 H    4.031200       1.667000      -1.935600    
 H    2.558600       3.923700       1.411100    
 H    4.224900       3.604300     -0.3988000    
 H   -6.176000       1.079700      0.8031000    
 H   -6.730000     -0.4981000      0.1997000    
 H   -6.143000      0.7150000     -0.9597000    


%chk=000226659-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226659

0 1
O -0.279794 -1.182885 -1.849704
O 2.537199 -3.454137 1.071886
O -4.863207 -0.105936 -0.059276
O -3.798793 1.965399 -0.038443
N 1.108005 -2.298959 -0.372158
C 0.141902 -0.040078 0.297705
C 0.203475 -0.652134 1.724410
C -1.200472 0.720915 0.044248
C 0.283720 -1.195698 -0.718966
C 1.521961 -1.411505 1.941087
C 1.289960 0.983389 0.053619
C -2.479702 -0.127139 0.183502
C 1.778183 -2.467998 0.877157
C 1.896929 1.119879 -1.221679
C 1.686117 1.876367 1.083524
C 1.288686 -3.343164 -1.413039
C -3.733545 0.716446 0.015838
C 2.884725 2.103116 -1.452989
C 2.670522 2.862202 0.853341
C 3.279114 2.978192 -0.416760
C -6.160237 0.598095 -0.209150
H -0.644294 -1.349089 1.860931
H 0.085352 0.135962 2.488195
H -1.168038 1.146932 -0.973228
H -1.242513 1.577677 0.742174
H 1.550617 -1.927780 2.915689
H 2.378773 -0.710256 1.926343
H -2.551699 -0.615470 1.174781
H -2.503392 -0.935196 -0.569189
H 1.588694 0.468387 -2.046578
H 1.224984 1.817466 2.075771
H 1.972997 -4.101604 -1.007608
H 1.708919 -2.892264 -2.326439
H 0.316060 -3.793800 -1.668483
H 3.341044 2.187438 -2.445585
H 2.958446 3.540264 1.664582
H 4.044268 3.741216 -0.596597
H -6.333514 1.269839 0.648541
H -6.911463 -0.203083 -0.244431
H -6.166988 1.191295 -1.138923


