%chk=000219552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219552

0 1
S 4.749760 0.050392 -0.470817
N -0.857800 -1.908975 -0.073303
N 4.774838 2.767645 0.396295
C -1.913493 -1.388213 -0.987814
C 0.429512 -1.337424 -0.113546
C -2.653518 -0.186548 -0.445554
C -1.395951 -2.344087 1.242580
C 1.325526 -1.472060 0.980289
C 0.897808 -0.720487 -1.306352
C -4.024592 -0.278567 -0.167592
C -1.979916 1.024183 -0.229047
C 2.635477 -1.020511 0.873623
C 2.208842 -0.274862 -1.400990
C 3.079046 -0.426306 -0.313847
C -4.716098 0.834523 0.319847
C -2.674348 2.132858 0.261443
C -4.043009 2.040784 0.535752
C 4.729311 1.666582 0.051849
H -2.613667 -2.232699 -1.192853
H -1.457617 -1.136770 -1.977816
H -0.700486 -3.061650 1.711732
H -2.355371 -2.868354 1.098242
H -1.568572 -1.504339 1.937200
H 0.998508 -1.930177 1.910136
H 0.228458 -0.608200 -2.159059
H -4.556941 -1.213365 -0.331683
H -0.912726 1.103335 -0.439293
H 3.314817 -1.128574 1.723264
H 2.556388 0.194713 -2.324829
H -5.781706 0.760521 0.531732
H -2.146998 3.071497 0.429389
H -4.582282 2.906635 0.915822


%chk=000219552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219552

0 1
S 4.956559 -0.122503 -1.067176
N -0.804101 -1.560373 0.371991
N 5.435419 2.381801 0.427823
C -1.924695 -1.397686 -0.568556
C 0.509425 -1.216989 0.041306
C -2.823842 -0.184895 -0.303739
C -1.110270 -2.201355 1.659195
C 1.605676 -1.652381 0.855680
C 0.812500 -0.412115 -1.106776
C -4.191560 -0.229407 -0.673437
C -2.307758 0.999105 0.278617
C 2.930816 -1.305926 0.535077
C 2.139706 -0.075211 -1.424989
C 3.199971 -0.518946 -0.604563
C -5.027707 0.892732 -0.477262
C -3.143224 2.121527 0.478432
C -4.504566 2.073693 0.098710
C 5.209693 1.365077 -0.167117
H -2.544630 -2.316203 -0.539307
H -1.520611 -1.348599 -1.596728
H -0.804165 -3.268336 1.684397
H -2.196428 -2.146722 1.836973
H -0.611380 -1.676025 2.494087
H 1.427516 -2.279345 1.733173
H 0.011225 -0.015112 -1.736734
H -4.605712 -1.145156 -1.115444
H -1.256060 1.036746 0.583790
H 3.752342 -1.654267 1.169387
H 2.346348 0.548618 -2.300524
H -6.083779 0.844208 -0.765785
H -2.731925 3.031608 0.929414
H -5.151584 2.943936 0.254886


