%chk=000216010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216010

0 1
S 0.006362 -1.788287 -0.201166
N 0.022473 1.304904 0.149271
C -1.226992 0.632535 -0.313894
C -1.354503 -0.725459 0.398314
C -2.430558 1.533498 0.043149
C -2.658254 -1.433417 0.041254
C -3.745985 0.829451 -0.314058
C -3.858897 -0.535656 0.378493
C 1.272102 0.665187 0.027108
C 1.397682 -0.736823 -0.060811
C 2.448934 1.452080 0.094494
C 2.654614 -1.343022 -0.066415
C 3.696581 0.835538 0.082561
C 3.808150 -0.558701 0.000297
H -1.202839 0.478503 -1.426670
H -1.261808 -0.595689 1.502104
H -2.362998 2.499186 -0.490362
H -2.413550 1.776907 1.124541
H -2.739056 -2.393012 0.590216
H -2.683227 -1.699055 -1.035910
H -3.819203 0.700518 -1.411734
H -4.601058 1.469918 -0.025138
H -3.928630 -0.397070 1.474964
H -4.796995 -1.037088 0.074295
H 0.028942 2.315193 0.016062
H 2.379006 2.533377 0.164214
H 2.740502 -2.429883 -0.123333
H 4.598166 1.445700 0.136712
H 4.787641 -1.028033 -0.008660


%chk=000216010-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216010

0 1
S 0.016013 -1.914287 -0.306179
N 0.024614 1.265811 -0.095091
C -1.252986 0.608468 -0.401284
C -1.364256 -0.760342 0.306383
C -2.418688 1.527293 0.043683
C -2.718799 -1.431904 0.012582
C -3.789276 0.873202 -0.242769
C -3.892378 -0.513906 0.435318
C 1.279062 0.643876 -0.043770
C 1.445138 -0.774005 -0.103598
C 2.448894 1.447790 0.095644
C 2.735142 -1.343644 -0.027163
C 3.731786 0.872030 0.158939
C 3.885397 -0.533070 0.093491
H -1.354408 0.418722 -1.494827
H -1.218024 -0.624204 1.393327
H -2.339954 2.500705 -0.482593
H -2.315116 1.731351 1.128607
H -2.777363 -2.401652 0.541576
H -2.787714 -1.648650 -1.072502
H -3.922309 0.757108 -1.337798
H -4.602314 1.535021 0.110673
H -3.881736 -0.385533 1.536851
H -4.853485 -0.997601 0.177302
H 0.021096 2.286304 -0.099455
H 2.335072 2.538821 0.147242
H 2.835716 -2.434839 -0.059227
H 4.609521 1.520113 0.260125
H 4.877959 -0.991677 0.144410


