%chk=000244612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244612

0 1
O 2.025492 0.749456 0.446382
O 1.845931 -1.466110 -0.313836
C 1.592050 -0.573856 0.785048
C 3.392069 0.890882 -0.027427
C 0.061591 -0.493187 0.895611
C 3.605934 -0.048894 -1.223039
C 3.188327 -1.466846 -0.835459
C -0.570846 0.024348 -0.403363
C 2.273471 -1.067294 2.058959
C 3.490251 2.364192 -0.394073
C -2.065948 0.103996 -0.278367
C -2.865396 -0.994456 -0.631656
C -2.674798 1.275417 0.198833
C -4.255377 -0.918591 -0.512232
C -4.065167 1.346334 0.316481
C -4.858800 0.250904 -0.038783
H 4.068798 0.631551 0.816403
H -0.205802 0.172933 1.739587
H -0.337567 -1.497876 1.138271
H 4.652727 -0.019513 -1.569084
H 2.985790 0.294995 -2.076549
H 3.094446 -2.136309 -1.710160
H 3.863049 -1.918889 -0.088568
H -0.270843 -0.637815 -1.244264
H -0.133304 1.015808 -0.651645
H 2.070992 -0.389929 2.897010
H 1.914189 -2.066220 2.332869
H 3.360328 -1.133271 1.951683
H 4.472726 2.617114 -0.802909
H 2.727265 2.640142 -1.134988
H 3.307061 2.996720 0.484876
H -2.400423 -1.907096 -0.999164
H -2.061335 2.129745 0.477858
H -4.870078 -1.773033 -0.789165
H -4.531603 2.257763 0.685682
H -5.940500 0.308382 0.052381


%chk=000244612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244612

0 1
O 2.028088 0.808125 0.400749
O 1.873682 -1.493363 -0.387885
C 1.583568 -0.563491 0.725102
C 3.447194 0.922202 -0.028044
C 0.050388 -0.493629 0.823278
C 3.694137 -0.027726 -1.219055
C 3.277539 -1.460982 -0.839805
C -0.634830 -0.002080 -0.479101
C 2.222707 -1.059616 2.039551
C 3.661184 2.399344 -0.359832
C -2.144392 0.086153 -0.317256
C -2.976674 -1.025098 -0.613064
C -2.755393 1.271063 0.170806
C -4.376200 -0.957091 -0.427104
C -4.154176 1.345508 0.358746
C -4.971055 0.229702 0.061081
H 4.107736 0.628490 0.818711
H -0.206401 0.183678 1.659043
H -0.322102 -1.501612 1.084917
H 4.763625 -0.007832 -1.507153
H 3.094390 0.316322 -2.082230
H 3.305946 -2.141687 -1.706321
H 3.949933 -1.867406 -0.053459
H -0.367488 -0.699413 -1.292711
H -0.210267 0.984716 -0.735987
H 1.962366 -0.368899 2.859795
H 1.834986 -2.063914 2.281553
H 3.322791 -1.122680 1.982646
H 4.705580 2.578941 -0.674429
H 2.987219 2.708029 -1.178277
H 3.445014 3.027823 0.521095
H -2.521684 -1.946583 -0.998225
H -2.127044 2.141970 0.397368
H -5.002155 -1.824856 -0.666124
H -4.607150 2.271612 0.731703
H -6.056361 0.285776 0.203122


