%chk=000126367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126367

0 1
 I   -7.306600      0.7628000       1.099500    
 O    2.053400      0.2477000     -0.4107000    
 O    3.547400       2.292200      0.9057000    
 O    3.914900      -1.584100      -1.561200    
 O    2.017200      -1.056000       1.487300    
 O   -4.621400       1.483700      -1.126500    
 N    3.428300      0.2968000     -0.2829000    
 N   -4.155100     -0.5828000     -9.9699996E-02
 C    5.520500       1.010700      0.3365000    
 C    5.642500     -0.2761000     -0.4826000    
 C    4.046900       1.314200      0.3713000    
 C    4.231300     -0.6308000     -0.8666000    
 C  -3.1500001E-02 -0.5095000      0.3973000    
 C    1.442800     -0.4837000      0.5736000    
 C   -2.770400     -0.5576000      6.7599997E-02
 C  -0.7357000      -1.614000      0.8302000    
 C  -0.6509000      0.5719000     -0.1950000    
 C   -2.120400      -1.638500      0.6634000    
 C   -2.035600      0.5477000     -0.3617000    
 C   -4.977000      0.3996000     -0.6712000    
 C   -6.440400      5.7000001E-03 -0.6741000    
 H    6.057900       1.836200     -0.1391000    
 H    5.894000      0.8704000       1.354900    
 H    6.079500      -1.084700      0.1104000    
 H    6.243100     -0.1179000      -1.383000    
 H  -0.2404000      -2.462900       1.292100    
 H  -0.1008000       1.448100     -0.5253000    
 H   -2.680200      -2.506700       1.001700    
 H   -2.466400       1.422000     -0.8290000    
 H   -4.616100      -1.423100      0.2427000    
 H   -6.544600      -1.082100     -0.7402000    
 H   -6.911600      0.4310000      -1.566500    


%chk=000126367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126367

0 1
I -7.364926 -1.436244 0.760876
O 2.112676 0.412879 -0.389711
O 3.694778 2.071233 1.386898
O 3.878052 -1.400050 -1.799165
O 2.104119 -1.191551 1.352788
O -4.699449 1.101930 -1.692386
N 3.523573 0.373265 -0.262468
N -4.246051 -0.437520 0.032607
C 5.703502 0.887027 0.452491
C 5.763871 -0.259758 -0.593373
C 4.220760 1.229746 0.633838
C 4.315210 -0.551049 -0.999121
C -0.010593 -0.434230 0.374091
C 1.451770 -0.500812 0.555112
C -2.829108 -0.398691 0.109816
C -0.815763 -1.255460 1.209812
C -0.631362 0.402982 -0.590072
C -2.210417 -1.237970 1.079379
C -2.030087 0.427493 -0.728493
C -5.077687 0.269303 -0.814354
C -6.591734 0.055232 -0.701533
H 6.240353 1.794726 0.128157
H 6.116168 0.595620 1.432935
H 6.204161 -1.186255 -0.187882
H 6.339026 0.008531 -1.495787
H -0.330032 -1.898116 1.950656
H -0.013238 1.034934 -1.232746
H -2.827151 -1.873998 1.725927
H -2.509626 1.069597 -1.468640
H -4.718319 -1.075403 0.685452
H -6.979260 -0.273117 -1.677361
H -7.068616 1.005924 -0.418843


