%chk=000190443.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190443

0 1
S 2.929637 0.899112 0.935156
N -4.077295 -0.280289 -0.395625
N 0.205182 -0.309707 0.364325
C -5.513904 -0.413063 -0.005189
C -4.479867 0.014572 1.013741
C -3.326718 -1.538370 -0.657888
C -1.840552 -1.198485 -0.836785
C -1.144634 -0.921106 0.506620
C 0.290289 1.104753 0.180982
C 1.313842 -1.157934 0.076822
C 1.514635 1.772591 0.390826
C 2.632395 -0.696030 0.280858
C -0.838931 1.873511 -0.172395
C 1.134892 -2.482506 -0.375486
C 1.626282 3.152461 0.235553
C 3.734392 -1.509070 0.031714
C -0.726727 3.258340 -0.303860
C 2.243188 -3.302076 -0.599561
C 0.497810 3.903836 -0.106467
C 3.541444 -2.825243 -0.402675
H -5.995145 -1.387651 0.074792
H -6.183671 0.325756 -0.455876
H -4.397113 1.065163 1.308302
H -4.212950 -0.650340 1.835261
H -3.459647 -2.322945 0.116276
H -3.721119 -1.964185 -1.610298
H -1.330396 -2.027264 -1.367920
H -1.741501 -0.315960 -1.507529
H -1.041647 -1.860197 1.096450
H -1.765745 -0.235262 1.130781
H -1.808068 1.403517 -0.354547
H 0.138947 -2.877860 -0.565175
H 2.586682 3.649045 0.385133
H 4.746790 -1.128072 0.179455
H -1.608868 3.840462 -0.572455
H 2.088807 -4.326040 -0.940204
H 0.574484 4.982077 -0.219776
H 4.397601 -3.468841 -0.587137


%chk=000190443-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190443

0 1
S 2.980441 0.966331 0.970116
N -3.979962 -0.134401 -0.291073
N 0.211723 -0.339822 0.306633
C -5.448911 -0.195953 0.045461
C -4.419480 -0.090024 1.157451
C -3.368274 -1.410767 -0.774931
C -1.843471 -1.247316 -0.931784
C -1.125269 -0.966344 0.419214
C 0.264052 1.082847 0.155387
C 1.345368 -1.179794 0.096891
C 1.477226 1.806952 0.341190
C 2.676606 -0.701111 0.275954
C -0.903669 1.834536 -0.169634
C 1.195292 -2.544182 -0.284996
C 1.535578 3.202796 0.163554
C 3.792984 -1.525896 0.037385
C -0.849138 3.239401 -0.304664
C 2.313798 -3.383343 -0.479573
C 0.368322 3.934614 -0.152804
C 3.622563 -2.879454 -0.333417
H -5.964819 -1.160009 -0.068089
H -6.036039 0.679533 -0.247952
H -4.254525 0.863722 1.668798
H -4.253957 -0.984339 1.775135
H -3.607559 -2.274885 -0.106406
H -3.806096 -1.629768 -1.767104
H -1.434577 -2.154534 -1.414709
H -1.655662 -0.410576 -1.627281
H -1.017617 -1.902087 0.998285
H -1.748508 -0.288213 1.024580
H -1.867671 1.340010 -0.324436
H 0.199255 -2.963483 -0.439953
H 2.493359 3.717379 0.298078
H 4.798189 -1.110096 0.167166
H -1.769719 3.782586 -0.544881
H 2.152915 -4.429742 -0.761562
H 0.415373 5.021828 -0.271011
H 4.494681 -3.519694 -0.498819


