%chk=000288259.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288259

0 1
O 2.174110 0.196189 1.166407
O 2.174082 -0.196691 -1.166295
N -1.555022 2.976179 -0.185366
N -3.704397 0.056332 2.084996
N -3.703632 -0.054244 -2.085769
N -1.556391 -2.975754 0.185216
C 3.074695 -0.000376 0.000067
C -1.556485 0.481987 0.636975
C -1.556597 -0.481496 -0.636941
C -0.302726 0.249191 1.537752
C -0.302761 -0.249022 -1.537694
C 0.881489 0.113447 0.667983
C 0.881473 -0.113594 -0.667901
C 3.893909 -1.269779 0.214348
C 3.894267 1.268799 -0.214196
C 3.026731 -2.504862 0.424183
C 3.027437 2.504122 -0.424050
C -1.566294 1.880502 0.172255
C -2.766303 0.242888 1.441900
C -2.766342 -0.242103 -1.441884
C -1.566770 -1.880008 -0.172217
H -0.430619 -0.664716 2.164727
H -0.177612 1.085454 2.263555
H -0.430407 0.664923 -2.164663
H -0.177853 -1.085312 -2.263501
H 4.559510 -1.125943 1.091386
H 4.558058 -1.422748 -0.662242
H 4.559848 1.124778 -1.091219
H 4.558438 1.421583 0.662409
H 2.379403 -2.392568 1.304202
H 2.376459 -2.687343 -0.441813
H 3.639876 -3.400692 0.574392
H 2.380098 2.392010 -1.304085
H 2.377195 2.686783 0.441931
H 3.640834 3.399783 -0.574243


%chk=000288259-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288259

0 1
O 2.161269 0.177773 1.193699
O 2.161286 -0.178251 -1.193540
N -1.486233 3.014093 -0.318140
N -3.809688 0.195977 2.091011
N -3.809528 -0.194493 -2.091324
N -1.486674 -3.013660 0.317466
C 3.091954 -0.000390 0.000109
C -1.593434 0.515519 0.631719
C -1.593553 -0.514844 -0.631786
C -0.344080 0.236778 1.552071
C -0.344060 -0.236493 -1.552062
C 0.851020 0.101373 0.669552
C 0.851029 -0.101469 -0.669470
C 3.917262 -1.277916 0.190825
C 3.917687 1.276868 -0.190550
C 3.081782 -2.559178 0.374878
C 3.082623 2.558384 -0.374724
C -1.539719 1.900642 0.103120
C -2.832881 0.341815 1.425196
C -2.832894 -0.340740 -1.425343
C -1.540331 -1.899988 -0.103186
H -0.529318 -0.676232 2.150326
H -0.232523 1.077406 2.260938
H -0.528971 0.676585 -2.150317
H -0.232727 -1.077147 -2.260932
H 4.570459 -1.117848 1.070212
H 4.579914 -1.376012 -0.690591
H 4.570929 1.116574 -1.069863
H 4.580274 1.374776 0.690936
H 2.434877 -2.488192 1.266152
H 2.445805 -2.750367 -0.506510
H 3.746313 -3.430720 0.507839
H 2.435805 2.487577 -1.266075
H 2.446594 2.749777 0.506583
H 3.747434 3.429722 -0.507615


