%chk=000207382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207382

0 1
I -1.376210 -1.566286 2.213263
I -1.285222 3.115836 -1.548710
I 2.216259 -1.484820 2.414722
I 2.291410 3.149613 -1.450278
O 5.433988 -2.292347 -0.934311
O -6.289423 -0.593889 0.950078
O -3.060409 1.508365 1.196488
O -4.574453 -2.032525 0.975267
O 3.932601 1.532509 1.419500
N -3.098908 0.040789 -0.542807
N 4.121394 0.166562 -0.397888
C -4.574202 -0.065430 -0.575795
C -4.892194 -0.645494 -1.968741
C -3.617101 -1.385440 -2.417944
C -2.456419 -0.828435 -1.569647
C -2.443401 0.827075 0.401783
C -5.059034 -1.030389 0.515614
C -0.927994 0.787982 0.367101
C 3.547003 -0.792558 -1.370950
C 5.595501 0.047471 -0.232652
C 3.998278 -2.225937 -1.034637
C 5.971755 -1.409952 0.074144
C 3.387682 0.860914 0.563336
C 1.874158 0.810010 0.448087
C -0.239063 -0.145023 1.154825
C -0.209266 1.729168 -0.378488
C 1.152796 -0.126377 1.200335
C 1.184882 1.739484 -0.340318
H -5.041796 0.942678 -0.398403
H -5.138840 0.174908 -2.669171
H -5.770826 -1.313407 -1.954010
H -3.724817 -2.474591 -2.257142
H -3.432734 -1.242020 -3.495880
H -1.885843 -1.645371 -1.075270
H -1.752312 -0.224363 -2.180290
H 3.917135 -0.506648 -2.385265
H 2.440668 -0.725814 -1.402633
H 5.941169 0.730110 0.580741
H 6.077073 0.386357 -1.177690
H 3.551167 -2.593136 -0.092258
H 3.787246 -2.932613 -1.857000
H 7.058283 -1.589536 -0.014013
H 5.611558 -1.732003 1.067062
H -6.666138 -1.151428 1.681443


%chk=000207382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207382

0 1
I -1.477601 -1.725761 2.382081
I -1.354303 2.890257 -1.596360
I 2.218051 -1.673093 2.566769
I 2.335096 2.884644 -1.500117
O 5.872437 -1.994546 -1.319026
O -6.619603 -0.069665 0.694335
O -3.113407 1.384572 1.309015
O -5.022637 -1.732952 0.998473
O 3.844264 1.490323 1.593605
N -3.176358 -0.050414 -0.515407
N 4.159729 0.016871 -0.191066
C -4.639389 0.087737 -0.658730
C -4.912176 -0.536173 -2.060355
C -3.805476 -1.614147 -2.194098
C -2.571413 -0.956946 -1.529204
C -2.513195 0.663061 0.454807
C -5.388923 -0.679835 0.438018
C -0.988275 0.586286 0.424521
C 3.662941 -0.857344 -1.274335
C 5.630245 0.189610 -0.160158
C 4.418591 -2.203321 -1.246708
C 6.321239 -1.185078 -0.170324
C 3.372690 0.737678 0.687749
C 1.858355 0.610744 0.526349
C -0.295873 -0.336984 1.254187
C -0.251894 1.508091 -0.366789
C 1.120571 -0.317435 1.309138
C 1.164203 1.516756 -0.320616
H -4.934370 1.147721 -0.590564
H -4.791516 0.248284 -2.828676
H -5.931712 -0.945839 -2.146037
H -4.091002 -2.522133 -1.635587
H -3.609862 -1.893483 -3.242352
H -1.910413 -1.696640 -1.045364
H -1.979191 -0.369608 -2.258819
H 3.834426 -0.362129 -2.251895
H 2.579984 -1.025343 -1.152745
H 5.886111 0.765073 0.745190
H 5.939228 0.771143 -1.052420
H 4.162255 -2.761966 -0.321294
H 4.162166 -2.810465 -2.130228
H 7.410385 -1.075089 -0.295012
H 6.107204 -1.726398 0.775948
H -7.106182 -0.582068 1.395698


