%chk=000228647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228647

0 1
O -0.364312 1.378939 0.103497
O -3.337475 1.041337 -0.372962
O 0.303309 0.405006 -1.822292
C -1.245767 2.318705 -0.607163
C -2.385781 1.576889 -1.323064
C -1.722569 3.230548 0.506758
C 1.174274 -0.358810 0.347428
C 2.650169 -0.311567 0.061701
C 0.374960 0.475867 -0.615421
C -3.168584 -0.252861 0.080896
C 3.129844 -0.545469 -1.236265
C 3.552233 -0.060053 1.105439
C 4.503713 -0.530132 -1.484407
C 4.926775 -0.048646 0.849691
C -2.359610 -1.221659 -0.524633
C -3.956893 -0.540135 1.213626
C 5.404912 -0.284245 -0.442629
C -2.343714 -2.508639 0.022117
C -3.919765 -1.830047 1.734645
C -3.113612 -2.816125 1.145952
H -0.609232 2.844397 -1.356382
H -3.018869 2.285367 -1.893535
H -2.005057 0.790263 -2.003315
H -0.891549 3.522881 1.163238
H -2.187613 4.140695 0.113410
H -2.467539 2.719815 1.139447
H 0.811302 -1.413115 0.281821
H 0.952877 -0.042595 1.394503
H 2.424832 -0.724000 -2.052264
H 3.189152 0.127657 2.113892
H 4.873218 -0.709513 -2.493207
H 5.625814 0.145995 1.661589
H -1.770955 -0.988657 -1.410512
H -4.574302 0.239096 1.651699
H 6.475122 -0.274665 -0.638712
H -1.725904 -3.278088 -0.440967
H -4.521870 -2.075811 2.609500
H -3.094134 -3.819025 1.563583


%chk=000228647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228647

0 1
O -0.115476 0.884954 -0.190980
O -3.123241 1.158006 0.195584
O 0.099732 0.123419 -2.386219
C -0.947704 2.046633 -0.657806
C -2.382296 1.597050 -0.993611
C -0.870263 3.079025 0.466609
C 1.293124 -1.027546 -0.542973
C 2.705196 -0.472364 -0.346440
C 0.376090 0.018435 -1.167290
C -3.265689 -0.213735 0.487427
C 3.688515 -0.643788 -1.352725
C 3.042594 0.241602 0.831249
C 4.988561 -0.115118 -1.183841
C 4.342252 0.768489 1.002284
C -2.755013 -1.280524 -0.292585
C -4.015397 -0.484083 1.659862
C 5.319783 0.591721 -0.004956
C -3.008079 -2.613093 0.110382
C -4.252513 -1.816734 2.050497
C -3.751910 -2.892977 1.277625
H -0.493564 2.424149 -1.596012
H -2.935331 2.480498 -1.361800
H -2.379952 0.832735 -1.788752
H 0.181333 3.330794 0.682704
H -1.399043 4.002562 0.169018
H -1.343996 2.686962 1.381046
H 1.311362 -1.895401 -1.222374
H 0.860673 -1.335854 0.423908
H 3.434124 -1.187715 -2.270199
H 2.283567 0.386901 1.608688
H 5.740298 -0.256505 -1.968525
H 4.592570 1.313938 1.919268
H -2.172877 -1.103121 -1.201472
H -4.401298 0.359411 2.240693
H 6.328328 0.998911 0.128391
H -2.615003 -3.434739 -0.499383
H -4.832570 -2.015040 2.958817
H -3.939486 -3.928259 1.580594


