%chk=000210244.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210244

2 1
N -1.126564 -3.269433 -0.528995
N -2.470628 1.450430 0.801214
N 3.366439 0.180872 -1.706257
C -1.490834 -2.277803 0.582261
C -2.036452 -0.933228 0.082639
C -1.837747 0.142400 1.165170
C -0.639981 -4.547994 0.125609
C -2.332334 -3.583799 -1.383810
C -0.016398 -2.714476 -1.391310
C -1.911980 2.300982 -0.143194
C -0.694923 1.893018 -0.913496
C 0.619742 2.146017 -0.141347
C 1.661108 1.174021 -0.557006
C -3.624909 1.819329 1.484651
C -2.519143 3.550034 -0.370331
C 1.982668 -0.063995 0.107214
C 3.056456 -0.669781 -0.633652
C -4.228195 3.044993 1.251230
C 2.529062 1.302912 -1.639256
C -3.666521 3.934816 0.317213
C 1.521574 -0.699079 1.277198
C 3.626632 -1.901280 -0.245257
C 2.086902 -1.902984 1.655977
C 3.128095 -2.502144 0.894599
H -0.569868 -2.117485 1.205299
H -2.238924 -2.760638 1.259097
H -1.514850 -0.607940 -0.852231
H -3.112199 -1.023383 -0.182951
H -0.733444 0.310493 1.352017
H -2.253855 -0.205510 2.143840
H 0.261383 -4.378003 0.748245
H -0.361121 -5.314704 -0.627011
H -1.412106 -5.009749 0.770989
H -2.693110 -2.703641 -1.944734
H -2.105492 -4.365404 -2.140296
H -3.178245 -3.970693 -0.782438
H 0.315913 -3.447619 -2.153958
H 0.884077 -2.451241 -0.789824
H -0.321328 -1.802328 -1.933305
H -0.750436 0.824527 -1.227993
H -0.648985 2.449513 -1.881640
H 0.466788 2.098057 0.956427
H 0.968829 3.188453 -0.326628
H -4.039661 1.112593 2.223401
H -2.065832 4.234656 -1.105465
H 2.610341 2.111803 -2.352248
H -5.141359 3.321499 1.803478
H -4.130104 4.917977 0.136357
H 4.131703 0.057571 -2.351848
H 0.769491 -0.205388 1.893120
H 4.454364 -2.336508 -0.806179
H 1.787603 -2.386614 2.586345
H 3.565855 -3.438124 1.251968


%chk=000210244-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210244

2 1
N -1.404526 -3.447446 -0.481300
N -2.558944 1.442432 0.662169
N 3.759419 0.749376 -1.425794
C -1.593017 -2.311331 0.551227
C -2.286786 -1.030179 0.032123
C -2.009322 0.102786 1.061105
C -0.813098 -4.651314 0.267732
C -2.736090 -3.854456 -1.111325
C -0.411616 -3.030706 -1.571784
C -1.837137 2.292042 -0.178680
C -0.489225 1.884589 -0.712605
C 0.750060 2.247742 0.217811
C 1.950669 1.456450 -0.223951
C -3.789353 1.813856 1.178444
C -2.398835 3.555841 -0.475805
C 2.284963 0.104264 0.195606
C 3.420048 -0.318039 -0.587469
C -4.356105 3.054174 0.885158
C 2.880996 1.810365 -1.208402
C -3.646182 3.949144 0.044985
C 1.786313 -0.774023 1.198177
C 4.020487 -1.586618 -0.433097
C 2.383170 -2.043779 1.360414
C 3.479230 -2.451085 0.541115
H -0.572477 -2.079170 0.907346
H -2.166391 -2.750632 1.386785
H -1.887039 -0.732933 -0.953059
H -3.375177 -1.179616 -0.080741
H -0.924663 0.212263 1.212212
H -2.454100 -0.153317 2.038035
H 0.148739 -4.353949 0.713583
H -0.654663 -5.473109 -0.446675
H -1.515275 -4.972323 1.052256
H -3.140653 -3.016318 -1.697094
H -2.565889 -4.714774 -1.776387
H -3.442174 -4.138340 -0.315609
H -0.212411 -3.901561 -2.214587
H 0.522345 -2.693539 -1.094074
H -0.845179 -2.225381 -2.181797
H -0.441407 0.801658 -0.911992
H -0.333863 2.385610 -1.682763
H 0.506347 2.027796 1.274927
H 0.927970 3.335360 0.157836
H -4.281007 1.091057 1.833594
H -1.835539 4.226667 -1.129946
H 2.985843 2.744697 -1.757885
H -5.326446 3.315863 1.313144
H -4.063059 4.930999 -0.196949
H 4.559698 0.772148 -2.057518
H 1.028656 -0.434124 1.917708
H 4.893829 -1.886247 -1.021432
H 2.062377 -2.698835 2.179583
H 3.943983 -3.428036 0.708541


