%chk=000147797.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147797

0 1
 O   -2.565500      -2.167900     -0.5019000    
 O    2.514500      -2.124200     -0.6017000    
 N   -1.730000      0.1529000      -1.864200    
 N    1.655500      0.2795000      -1.795800    
 N   -6.309100       2.757400       1.308500    
 N    6.402000       2.647100       1.316000    
 N   -4.862200       3.778400     -0.2163000    
 N    4.901600       3.770600     -7.9599999E-02
 C  -1.5400000E-02  -3.074600      0.5138000    
 C   -1.278300      -3.933300      0.4782000    
 C    1.244500      -3.932400      0.3644000    
 C   -2.537700      -3.084900      0.5831000    
 C    2.519200      -3.100100      0.4301000    
 C   -3.208100     -0.9761000     -0.2882000    
 C    3.182700     -0.9537000     -0.3500000    
 C   -2.808600      0.1829000     -0.9536000    
 C    2.772000      0.2455000     -0.9321000    
 C   -4.275300     -0.9327000      0.6090000    
 C    4.287500     -0.9733000      0.5015000    
 C   -3.476100       1.385500     -0.7216000    
 C    3.465900       1.425100     -0.6629000    
 C   -4.543200       1.429000      0.1757000    
 C    4.570700       1.405500      0.1884000    
 C   -4.942800      0.2700000      0.8409000    
 C    4.981400      0.2062000      0.7706000    
 C   -5.239600       2.682600      0.4180000    
 C    5.294700       2.635000      0.4696000    
 H  -4.5400001E-02  -2.331900     -0.2915000    
 H   2.6000001E-02  -2.522000       1.460300    
 H   -1.300000      -4.490100     -0.4668000    
 H   -1.260700      -4.665500       1.293500    
 H    1.271900      -4.699600       1.146800    
 H    1.204300      -4.448000     -0.6030000    
 H   -2.517100      -2.575300       1.555400    
 H   -3.419600      -3.733500      0.5315000    
 H    2.560700      -2.644000       1.428100    
 H    3.386800      -3.756900      0.2988000    
 H   -4.640000      -1.815700       1.125200    
 H    4.661500      -1.888300      0.9512000    
 H   -3.148900       2.277800      -1.250100    
 H    3.129600       2.349500      -1.126700    
 H   -5.769600      0.2469000       1.542200    
 H    5.836800      0.1341000       1.433300    
 H   -1.441100      0.9977000      -2.339000    
 H   -1.242600     -0.7165000      -2.036200    
 H    1.358600       1.153000      -2.209700    
 H    1.146800     -0.5725000      -1.991900    
 H   -6.783700       3.641200       1.462700    
 H   -6.661900       1.968200       1.835200    
 H    6.892900       3.515700       1.501500    
 H    6.767900       1.824700       1.779100    
 H   -5.469100       4.549400      8.3600000E-02
 H    5.530500       4.516600      0.2378000    


%chk=000147797-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147797

0 1
O -2.448227 -2.176634 -0.217340
O 2.071259 -1.668800 -0.171422
N -1.780632 -0.152539 -1.808930
N 1.258943 0.868003 -0.640933
N -6.204646 2.975430 1.104846
N 6.922734 2.497619 1.073954
N -5.362821 3.467820 -1.110169
N 5.452040 3.803838 -0.335166
C -0.020574 -3.428820 0.877235
C -1.345427 -4.161965 0.548095
C 1.175994 -3.907133 0.026493
C -2.566558 -3.262025 0.773854
C 2.427203 -3.043975 0.220106
C -3.256297 -1.032660 -0.085928
C 3.056706 -0.668637 -0.029397
C -2.885134 0.033161 -0.969203
C 2.588270 0.662312 -0.291736
C -4.344921 -0.894700 0.793223
C 4.398191 -0.901784 0.326497
C -3.630941 1.229961 -0.928142
C 3.513886 1.726548 -0.179293
C -4.721615 1.385069 -0.035770
C 4.863520 1.501153 0.184569
C -5.079705 0.315244 0.822039
C 5.306644 0.178245 0.434827
C -5.459309 2.689947 -0.046884
C 5.774682 2.686237 0.291558
H -0.157927 -2.350520 0.684617
H 0.217515 -3.534991 1.955023
H -1.350585 -4.475966 -0.514204
H -1.458674 -5.082295 1.153813
H 1.438492 -4.957698 0.265986
H 0.894744 -3.881581 -1.044762
H -2.566797 -2.828951 1.795595
H -3.518630 -3.806845 0.611838
H 2.761718 -3.046175 1.279243
H 3.259577 -3.407135 -0.417250
H -4.641104 -1.724235 1.442935
H 4.753810 -1.920400 0.508932
H -3.394950 2.069666 -1.590597
H 3.208650 2.758868 -0.381164
H -5.958993 0.381958 1.471770
H 6.358326 -0.036055 0.653401
H -1.599976 0.512800 -2.556463
H -1.401137 -1.093751 -1.893771
H 0.908511 1.811624 -0.775112
H 0.593867 0.098417 -0.674988
H -6.772436 3.818604 1.149991
H -6.094683 2.425704 1.953664
H 7.616288 3.238078 1.151195
H 7.024645 1.678621 1.668595
H -5.876185 4.368183 -1.009673
H 6.127570 4.578155 -0.164396


