%chk=000182880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182880

0 1
O -0.196123 2.789775 0.194836
O 0.898487 1.148977 -2.191406
O 3.437846 1.068688 -0.152074
O -2.710316 -0.519355 0.051359
O -0.773583 -1.756821 -0.070184
O 4.823044 0.825735 1.601164
N -0.713330 0.532229 0.252077
C 0.774585 0.619346 0.236032
C -1.348469 1.898728 0.200506
C 1.331452 0.261880 -1.165632
C 0.991548 2.090831 0.644737
C 2.876039 0.217213 -1.207651
C -2.179583 2.149963 1.448666
C -2.079259 2.152082 -1.108243
C -1.353586 -0.689760 0.052677
C 3.461209 -1.153857 -0.926702
C -3.614082 -1.709674 -0.083004
C 4.263612 -1.100222 0.143207
C 4.283041 0.290560 0.678722
C -3.363965 -2.633957 1.097364
C -4.967488 -1.007102 -0.018374
C -3.343415 -2.361957 -1.429017
H 1.202271 -0.093683 0.986687
H 0.912169 -0.724931 -1.504992
H 1.080677 2.219027 1.736145
H 1.831150 2.598103 0.136279
H 3.248207 0.661404 -2.161961
H -1.584610 2.036866 2.363372
H -2.583698 3.169412 1.450166
H -3.019966 1.443205 1.508580
H -2.371921 3.204724 -1.199323
H -1.446701 1.912369 -1.976900
H -2.983782 1.530997 -1.179130
H 3.215641 -2.001935 -1.549233
H 0.811920 2.077616 -1.853417
H 4.840339 -1.879854 0.616430
H -4.075152 -3.466114 1.116871
H -2.350934 -3.068911 1.054676
H -3.441160 -2.103781 2.053692
H -5.081697 -0.279797 -0.831972
H -5.087011 -0.453597 0.921647
H -5.789431 -1.727339 -0.092281
H -3.397003 -1.638191 -2.250691
H -2.334007 -2.805556 -1.460284
H -4.058768 -3.163234 -1.640821


%chk=000182880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182880

0 1
O -0.138101 2.853767 0.060712
O 1.215069 1.685276 -2.140454
O 3.657353 1.040417 -0.300954
O -2.701620 -0.518317 0.002220
O -0.657658 -1.719245 -0.077138
O 5.076117 0.693970 1.536044
N -0.699418 0.602508 0.061142
C 0.783514 0.680762 0.120719
C -1.343614 1.967404 0.111624
C 1.405208 0.508564 -1.292446
C 0.972290 2.095619 0.706373
C 2.917259 0.165308 -1.253248
C -2.103982 2.193537 1.429510
C -2.176272 2.295507 -1.132779
C -1.309047 -0.634681 -0.012314
C 3.238728 -1.241007 -0.793869
C -3.576902 -1.769293 -0.076036
C 4.082809 -1.204385 0.271754
C 4.377763 0.210142 0.629775
C -3.312096 -2.651103 1.160170
C -4.990923 -1.163366 -0.045763
C -3.305690 -2.505493 -1.402631
H 1.166120 -0.113756 0.783878
H 0.901203 -0.350958 -1.778636
H 0.860284 2.099936 1.805748
H 1.914813 2.576706 0.415527
H 3.318679 0.379688 -2.262566
H -1.442361 2.040200 2.299252
H -2.489949 3.226408 1.458053
H -2.948776 1.489387 1.500686
H -2.463663 3.360458 -1.106543
H -1.591656 2.106732 -2.049066
H -3.086046 1.675849 -1.151653
H 2.820683 -2.125632 -1.278580
H 0.719173 2.387461 -1.629623
H 4.502859 -2.038590 0.832426
H -4.027313 -3.493925 1.170993
H -2.288050 -3.055128 1.142596
H -3.454316 -2.068290 2.087738
H -5.146689 -0.491524 -0.907671
H -5.148942 -0.586828 0.882224
H -5.744649 -1.969564 -0.089446
H -3.441836 -1.822341 -2.259859
H -2.283113 -2.912502 -1.424739
H -4.023047 -3.339577 -1.510552


