%chk=000288798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288798

0 1
N 2.134293 0.155582 -0.484133
N -1.192811 -0.452125 -0.935375
N -0.696981 -1.707320 -0.650006
C 2.600076 1.568734 -0.344697
C 0.892825 -0.173278 0.241578
C 4.145061 1.543526 -0.367201
C 2.069571 2.489231 -1.469435
C -0.398464 0.614409 -0.215028
C 4.705696 2.962259 -0.210149
C 2.620642 3.909794 -1.301919
C 4.156295 3.908036 -1.287582
C 0.472779 -1.630164 -0.050297
C -1.084844 1.238094 0.975720
C 1.271634 -2.802129 0.317498
C -2.591758 -0.317473 -1.220819
C -1.822966 0.462773 1.881528
C -0.946846 2.617532 1.194181
C 2.575496 -2.656886 0.822758
C 0.728029 -4.093891 0.175410
C -3.142562 0.972276 -1.360374
C -3.388710 -1.455823 -1.464866
C -2.423590 1.064431 2.990646
C -1.546392 3.213624 2.306794
C -2.286505 2.439341 3.205973
C 3.317191 -3.784282 1.183239
C 1.476170 -5.215288 0.537541
C -4.478047 1.109448 -1.743826
C -4.718797 -1.293257 -1.847551
C 2.771139 -5.063886 1.043832
C -5.270946 -0.014837 -1.988334
H 2.261704 1.970033 0.645182
H 1.071789 -0.030094 1.336642
H 4.506737 1.090647 -1.309443
H 4.518545 0.887708 0.441933
H 0.959571 2.499454 -1.465401
H 2.364439 2.090566 -2.459091
H -0.143184 1.399126 -0.979523
H 2.083349 -0.133652 -1.466288
H 5.810487 2.934062 -0.262961
H 4.459706 3.355279 0.795108
H 2.237109 4.356869 -0.364761
H 2.252716 4.554858 -2.121980
H 4.532890 4.933595 -1.116875
H 4.538182 3.602858 -2.280995
H -1.936691 -0.609866 1.719691
H -0.371906 3.229613 0.501350
H 3.020152 -1.663949 0.922278
H -0.280811 -4.217719 -0.222422
H -2.545835 1.860367 -1.171133
H -2.965095 -2.455328 -1.363204
H -3.001021 0.458518 3.687940
H -1.437724 4.284288 2.472485
H -2.755490 2.905652 4.070381
H 4.326677 -3.663586 1.572500
H 1.048931 -6.210160 0.424065
H -4.903158 2.106962 -1.851060
H -5.333412 -2.172795 -2.037970
H 3.352221 -5.939335 1.326488
H -6.309355 0.101679 -2.285843


%chk=000288798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288798

0 1
N 1.807815 0.333578 -0.676513
N -1.484108 -0.463678 -0.589847
N -0.854100 -1.689542 -0.400786
C 2.649247 1.532052 -0.496304
C 0.719330 0.003268 0.230263
C 4.082945 1.249990 -1.015555
C 2.088303 2.822800 -1.166681
C -0.709058 0.680194 -0.036785
C 5.024397 2.462700 -0.822376
C 3.027530 4.037810 -0.967442
C 4.453195 3.737359 -1.486991
C 0.355839 -1.490746 0.119251
C -1.328914 1.262268 1.229533
C 1.225591 -2.606554 0.504574
C -2.715565 -0.384008 -1.268711
C -1.998557 0.432912 2.164394
C -1.177970 2.641955 1.520520
C 2.534662 -2.370516 1.014141
C 0.768286 -3.954659 0.401624
C -3.380196 0.867738 -1.402807
C -3.302583 -1.551043 -1.835319
C -2.500930 0.973375 3.368097
C -1.681521 3.184232 2.723994
C -2.343205 2.349811 3.654290
C 3.356456 -3.446346 1.410139
C 1.594825 -5.024565 0.792947
C -4.605747 0.942918 -2.097052
C -4.529221 -1.456549 -2.520158
C 2.894436 -4.778567 1.301842
C -5.192054 -0.212797 -2.661763
H 2.709115 1.716569 0.598494
H 1.044405 0.267621 1.253996
H 4.025369 1.000832 -2.097070
H 4.480631 0.354395 -0.502478
H 1.083490 3.051331 -0.761858
H 1.962270 2.626039 -2.252472
H -0.594756 1.467794 -0.802990
H 1.707771 -0.002614 -1.638409
H 6.025507 2.229908 -1.233824
H 5.162377 2.649425 0.263056
H 3.079539 4.285326 0.113629
H 2.609527 4.927291 -1.477612
H 5.120076 4.600561 -1.297532
H 4.418269 3.592780 -2.586715
H -2.139218 -0.630413 1.938739
H -0.671025 3.297270 0.800345
H 2.910120 -1.344204 1.069681
H -0.240481 -4.139154 0.018753
H -2.958720 1.770580 -0.950807
H -2.784619 -2.507124 -1.729814
H -3.020360 0.322909 4.080703
H -1.564509 4.253769 2.932655
H -2.737657 2.768098 4.586999
H 4.361279 -3.246666 1.799732
H 1.227086 -6.053541 0.707339
H -5.107019 1.913293 -2.189480
H -4.969964 -2.362893 -2.951461
H 3.535004 -5.613045 1.608324
H -6.144432 -0.147423 -3.198245


