%chk=000206943.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206943

0 1
I -2.898920 -1.869537 -0.879368
I -0.643910 3.580586 0.690453
I 2.686672 -1.332049 1.552164
O 0.316234 -4.715917 -0.520955
O -4.212422 2.486890 -1.479413
O 1.965468 2.010883 2.689609
O 2.711578 -0.274209 -1.840518
O 4.679998 0.415760 -1.007530
N -0.061398 -2.748465 0.534147
N -2.857806 1.267119 -0.135724
N 2.758174 2.213409 0.559333
C -0.221807 -1.322972 0.525762
C -1.589153 0.680522 0.183886
C -1.408856 -0.715006 0.075428
C 0.696720 0.885676 0.999221
C -0.508956 1.477706 0.616591
C 0.836546 -0.502146 0.971333
C -0.278525 -3.440270 1.846720
C -3.936961 1.125915 0.896874
C 0.275161 -3.505973 -0.621249
C -3.123677 1.966000 -1.346617
C 1.848837 1.733419 1.513740
C 0.588798 -2.731853 -1.883868
C -2.022727 1.971256 -2.386202
C -1.754988 -3.603042 2.181298
C -3.724046 2.052895 2.085495
C 2.681534 1.873592 -0.865076
C 1.592074 -3.499549 -2.736318
C -2.604131 2.213946 -3.774100
C 4.019648 2.844423 1.017863
C 3.512059 0.638936 -1.192035
H 0.213221 -4.442886 1.774248
H 0.247070 -2.869861 2.645541
H -4.907838 1.360797 0.392326
H -3.983763 0.064017 1.226987
H 0.974816 -1.711814 -1.670854
H -0.360042 -2.583767 -2.449625
H -1.297417 2.777160 -2.131342
H -1.451287 1.021074 -2.382028
H -1.880407 -4.156791 3.119559
H -2.285120 -4.164469 1.398547
H -2.267836 -2.641132 2.293309
H -2.788478 1.846023 2.618982
H -3.689400 3.106933 1.774264
H -4.544103 1.954511 2.806690
H 1.621349 1.726141 -1.189278
H 3.071258 2.726108 -1.478830
H 1.754323 -3.009714 -3.702046
H 1.236072 -4.523226 -2.936922
H 2.559939 -3.605695 -2.231651
H -1.814849 2.357389 -4.519201
H -3.247851 3.107155 -3.784888
H -3.230396 1.374011 -4.101690
H 4.896950 2.239533 0.721712
H 4.112513 3.858113 0.596496
H 4.020082 2.933031 2.123315
H 3.185576 -1.126388 -2.057767


%chk=000206943-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206943

0 1
I -3.160110 -1.803897 -0.559327
I -0.528249 3.647429 0.616029
I 2.618287 -1.546859 1.550589
O 0.288671 -4.786331 -0.445510
O -4.274822 2.431507 -1.602735
O 2.002638 1.912013 2.787580
O 3.222149 0.223667 -2.497138
O 4.885488 0.580930 -0.909043
N -0.223529 -2.779177 0.593473
N -2.859294 1.397047 -0.072786
N 2.859725 2.108020 0.620892
C -0.316732 -1.349661 0.593645
C -1.617963 0.754802 0.243059
C -1.504688 -0.669005 0.202646
C 0.742264 0.859487 1.017462
C -0.467427 1.496440 0.640498
C 0.794253 -0.555167 1.005348
C -0.372650 -3.503064 1.898222
C -3.926919 1.406743 0.975172
C 0.171192 -3.529249 -0.534179
C -3.160003 1.885889 -1.364786
C 1.920678 1.669721 1.547186
C 0.439447 -2.772805 -1.839698
C -2.084352 1.689385 -2.440946
C -1.744480 -4.173017 2.102023
C -3.724461 2.442762 2.095295
C 2.742272 1.861454 -0.816643
C 1.513399 -3.479103 -2.692721
C -2.560271 2.156383 -3.828001
C 4.012395 2.905717 1.088053
C 3.751515 0.838502 -1.355597
H 0.415364 -4.276185 1.919913
H -0.167739 -2.776403 2.704472
H -4.865886 1.612163 0.433506
H -3.992276 0.389718 1.405930
H 0.728934 -1.725196 -1.641834
H -0.515759 -2.736924 -2.401693
H -1.173122 2.245757 -2.143914
H -1.800860 0.618350 -2.470075
H -1.722350 -4.758275 3.040263
H -1.961726 -4.864651 1.271528
H -2.561506 -3.435604 2.176130
H -2.787068 2.274214 2.654268
H -3.710046 3.468531 1.691557
H -4.564053 2.363873 2.810755
H 1.729829 1.517097 -1.074536
H 2.908931 2.807679 -1.371686
H 1.614015 -2.981842 -3.674126
H 1.241752 -4.535209 -2.853064
H 2.494787 -3.462131 -2.185239
H -1.759779 2.014013 -4.576126
H -2.842875 3.222235 -3.808208
H -3.450047 1.589752 -4.150385
H 4.954499 2.392716 0.832929
H 3.996740 3.907802 0.617868
H 3.931514 3.015579 2.179678
H 3.885904 -0.413425 -2.879176


