%chk=000247131.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247131

0 1
N 2.514035 0.323057 1.307942
N -0.675524 -2.439846 -0.935262
N -2.083174 1.556365 1.275440
N 4.640531 1.677125 -0.150836
N -1.384457 -5.057754 0.131536
N -3.227928 3.787901 -0.205447
N 0.944462 -1.088093 0.188976
N 0.251989 1.071049 1.101983
N -1.416073 -0.454813 0.172255
C 3.636329 -0.436705 0.682774
C 2.930590 1.714536 1.650539
C -2.083003 -2.937991 -0.958942
C 0.294269 -3.575249 -0.942962
C -1.751853 2.970644 1.617605
C -3.426925 1.458007 0.633347
C 4.197260 0.299438 -0.550743
C 3.489816 2.455347 0.419018
C -2.355693 -3.914803 0.202692
C 0.027245 -4.553580 0.218714
C -1.849589 3.887761 0.381672
C -3.528418 2.371982 -0.604592
C 1.214003 0.113719 0.823413
C -0.381167 -1.321774 -0.136958
C -1.056295 0.722727 0.807362
C 5.219103 2.395103 -1.325381
C -1.653205 -6.032741 1.230301
C -3.354628 4.695208 -1.384654
H 3.304451 -1.462204 0.404012
H 4.425821 -0.545027 1.461817
H 3.712252 1.631381 2.440649
H 2.077121 2.279289 2.088947
H -2.226865 -3.449996 -1.938057
H -2.797593 -2.085239 -0.923042
H 1.339041 -3.194104 -0.895203
H 0.175022 -4.093844 -1.921912
H -0.735980 3.033989 2.068791
H -2.480169 3.292432 2.397460
H -4.174566 1.761868 1.401880
H -3.649149 0.403156 0.355121
H 5.085348 -0.248881 -0.931879
H 3.440919 0.299377 -1.365338
H 2.674266 2.635107 -0.314283
H 3.871510 3.450571 0.732566
H -2.321706 -3.367669 1.169971
H -3.381220 -4.329658 0.099964
H 0.708984 -5.426083 0.127472
H 0.259343 -4.059530 1.187320
H -1.685992 4.941456 0.693819
H -1.044273 3.632841 -0.340583
H -2.863251 1.990809 -1.409497
H -4.566739 2.340353 -0.998935
H 4.527415 2.545491 -2.167181
H 6.094324 1.834265 -1.691691
H 5.586363 3.380874 -0.996976
H -0.965181 -6.887328 1.126782
H -2.675039 -6.429010 1.115249
H -1.551489 -5.627679 2.247972
H -4.388308 4.646404 -1.763939
H -2.669907 4.476548 -2.217133
H -3.183451 5.733525 -1.057438


%chk=000247131-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247131

0 1
N 2.572689 0.614037 0.738111
N -0.705608 -2.572879 -0.392146
N -1.976509 1.827097 0.701977
N 5.181907 1.560608 0.029293
N -1.451680 -5.294049 0.113578
N -3.764000 3.941418 -0.033571
N 0.968973 -1.013797 0.166710
N 0.310673 1.266987 0.727116
N -1.387299 -0.383132 0.142428
C 3.672897 -0.346558 0.549214
C 2.997675 1.963928 1.144537
C -2.100773 -2.999245 -0.591824
C 0.290693 -3.646046 -0.548271
C -1.681272 3.210744 1.110242
C -3.405899 1.538958 0.497505
C 4.713339 0.230184 -0.431606
C 4.046243 2.507918 0.154251
C -2.425327 -4.194132 0.327253
C -0.064887 -4.831540 0.371407
C -2.310035 4.201628 0.110570
C -4.010773 2.552396 -0.494344
C 1.247634 0.280005 0.536510
C -0.365260 -1.287882 -0.016706
C -0.990292 0.877725 0.517262
C 6.269404 2.094839 -0.812015
C -1.791553 -6.501944 0.889242
C -4.432083 4.942626 -0.886319
H 3.244434 -1.286889 0.171195
H 4.165406 -0.535821 1.524959
H 3.450211 1.915357 2.156187
H 2.105846 2.607541 1.177358
H -2.239134 -3.309476 -1.647622
H -2.754818 -2.141214 -0.375697
H 1.280279 -3.233180 -0.301729
H 0.289910 -3.994305 -1.601144
H -0.588279 3.327933 1.156927
H -2.111209 3.394669 2.116175
H -3.938867 1.623577 1.466791
H -3.497162 0.508525 0.122785
H 5.583062 -0.451670 -0.483711
H 4.257239 0.285207 -1.454167
H 3.551559 2.691273 -0.834916
H 4.433155 3.475346 0.526180
H -2.424350 -3.843711 1.391962
H -3.439235 -4.570067 0.093412
H 0.628729 -5.670143 0.172282
H 0.072967 -4.516393 1.438358
H -2.171642 5.233989 0.483507
H -1.776200 4.115281 -0.871401
H -3.574034 2.371155 -1.510728
H -5.103381 2.391579 -0.559939
H 5.963286 2.272871 -1.874671
H 7.118267 1.387377 -0.815999
H 6.625834 3.053919 -0.394695
H -1.079482 -7.311676 0.647656
H -2.805629 -6.846112 0.616872
H -1.767405 -6.340041 1.997263
H -5.519257 4.746121 -0.908325
H -4.060206 4.946560 -1.942860
H -4.275768 5.952629 -0.466170


