%chk=000277707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277707

0 1
I 7.169506 1.674400 0.098802
I -3.054619 -3.439895 -0.892544
I -7.087169 0.738698 -0.253309
O -4.021855 2.641093 0.132786
O 0.144138 1.104267 -0.143974
O 4.208875 -2.226647 2.415102
O 2.321995 -2.731566 1.334904
N 1.382061 -0.856806 -0.387940
N -0.978189 -0.922372 -0.424824
C 2.672987 -0.251259 -0.282912
C 3.049286 0.846632 -1.105389
C 3.621472 -0.814635 0.609960
C 4.335409 1.382526 -0.970854
C 4.911495 -0.260082 0.715856
C -2.318593 -0.458031 -0.370758
C 2.125737 1.430189 -2.117612
C 5.247097 0.833154 -0.066265
C 0.175418 -0.099934 -0.292225
C -2.634793 0.879508 -0.146702
C -3.376815 -1.392047 -0.548372
C -3.986312 1.302329 -0.095802
C 3.281464 -1.986212 1.434282
C -4.696971 -0.968553 -0.497383
C -5.025031 0.376543 -0.273223
C -5.262039 3.377634 0.258136
H 1.349333 -1.867838 -0.134155
H 4.626211 2.237561 -1.590551
H 5.626730 -0.703377 1.420535
H 2.642007 2.056883 -2.855811
H 1.579737 0.656876 -2.677281
H 1.361849 2.068996 -1.628621
H -0.859271 -1.939439 -0.590435
H -1.853296 1.640128 -0.001480
H -5.504737 -1.701910 -0.636005
H -5.824996 3.340814 -0.680117
H -4.880985 4.391226 0.447970
H -5.840839 3.011776 1.112372
H 3.970401 -3.025130 2.967938


%chk=000277707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000277707

0 1
I 7.027767 1.864044 0.342315
I -2.806815 -3.635425 -1.069533
I -7.395502 0.353371 -0.369774
O -4.889203 2.289168 0.001775
O -0.145603 1.280208 -0.179853
O 4.042186 -2.249502 2.473416
O 2.030411 -2.595745 1.397318
N 1.181429 -0.685912 -0.242945
N -1.110087 -0.849901 -0.543068
C 2.467578 -0.106852 -0.159998
C 2.872050 0.985920 -0.993036
C 3.424497 -0.689541 0.747380
C 4.169828 1.522402 -0.819698
C 4.724419 -0.132505 0.886462
C -2.492224 -0.558792 -0.505002
C 2.001012 1.536193 -2.102084
C 5.076606 0.986046 0.121777
C -0.037968 0.027373 -0.319706
C -2.977409 0.754972 -0.271249
C -3.440712 -1.602272 -0.706039
C -4.363849 1.022419 -0.227957
C 3.081646 -1.893396 1.531345
C -4.825583 -1.338877 -0.668262
C -5.293925 -0.033462 -0.428682
C -3.949039 3.398514 0.213312
H 1.144075 -1.634946 0.182168
H 4.475697 2.358273 -1.456712
H 5.420089 -0.593491 1.589849
H 2.614523 2.077829 -2.841415
H 1.464420 0.724598 -2.627377
H 1.230547 2.218216 -1.702403
H -0.877804 -1.826659 -0.757461
H -2.238177 1.545519 -0.132422
H -5.539767 -2.150420 -0.822844
H -4.587300 4.278906 0.374134
H -3.309162 3.552439 -0.675760
H -3.316488 3.221194 1.103258
H 3.744534 -3.074407 2.942869


