%chk=000206890.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206890

0 1
N -2.192359 0.059814 0.174539
N -1.141610 -0.659770 0.821127
N 2.942773 0.016075 -0.238696
C -4.946529 0.430079 -0.737615
C -3.793405 0.170998 -1.714520
C -4.414654 1.089806 0.540392
C -2.683729 -0.663068 -1.057788
C -3.301806 0.247044 1.180497
C 0.190153 -0.390026 0.393229
C 1.104939 -1.487250 0.382529
C 0.669788 0.914867 0.098356
C 2.481285 -1.224369 0.070745
C 2.065797 1.060094 -0.227188
C 0.733646 -2.850429 0.661373
C -0.128538 2.112730 0.125805
C 3.436111 -2.315781 0.066086
C 2.596251 2.364594 -0.558096
C 1.651792 -3.858595 0.644323
C 0.403945 3.332397 -0.180707
C 3.030363 -3.584025 0.345135
C 1.786851 3.459789 -0.537451
H -5.707321 1.078418 -1.211680
H -5.462408 -0.517689 -0.493273
H -4.159286 -0.348477 -2.619571
H -3.371458 1.137514 -2.060007
H -4.024746 2.100952 0.304017
H -5.231666 1.236111 1.271184
H -3.051215 -1.688255 -0.843127
H -1.823312 -0.758602 -1.757115
H -2.872635 0.780669 2.058845
H -3.712366 -0.714017 1.555697
H -1.332048 -1.672181 0.957572
H -0.311076 -3.067785 0.893541
H -1.182713 2.033637 0.405075
H 4.473699 -2.069449 -0.166820
H 3.654775 2.423868 -0.814902
H 1.366200 -4.886645 0.856222
H -0.207209 4.231488 -0.156459
H 3.734485 -4.415639 0.347703
H 2.170240 4.449509 -0.784079


%chk=000206890-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206890

0 1
N -2.257413 -0.017337 -0.093781
N -1.131275 -0.836479 0.201905
N 3.074249 0.064019 0.115522
C -5.108615 0.576775 -0.445465
C -4.154141 0.407426 -1.649718
C -4.321252 1.056122 0.795466
C -2.983224 -0.530560 -1.295423
C -3.142379 0.109933 1.102784
C 0.212512 -0.478596 0.117616
C 1.177889 -1.544585 0.304919
C 0.703759 0.858534 -0.111617
C 2.592884 -1.203508 0.311397
C 2.154118 1.056457 -0.102405
C 0.819454 -2.927560 0.481982
C -0.130442 2.013432 -0.335523
C 3.562967 -2.245243 0.529450
C 2.679751 2.379453 -0.322127
C 1.784721 -3.913885 0.683179
C 0.418317 3.277487 -0.541734
C 3.175703 -3.567923 0.716097
C 1.840183 3.466434 -0.537123
H -5.915410 1.292283 -0.689732
H -5.595242 -0.394992 -0.221020
H -4.692197 -0.002688 -2.524986
H -3.745852 1.393635 -1.943577
H -3.924765 2.073815 0.613898
H -4.979094 1.111224 1.683192
H -3.375999 -1.563199 -1.106446
H -2.257520 -0.589676 -2.124577
H -2.528097 0.498339 1.933140
H -3.538289 -0.893123 1.408436
H -1.342465 -1.810441 0.453299
H -0.227285 -3.254663 0.440810
H -1.211944 1.866184 -0.350689
H 4.613815 -1.939584 0.534212
H 3.769571 2.477951 -0.308739
H 1.480176 -4.958821 0.807794
H -0.242698 4.135072 -0.711217
H 3.926942 -4.348716 0.878460
H 2.259587 4.465402 -0.702761


