%chk=000269310.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269310

0 1
O 3.911912 -0.825717 -0.063941
O 3.759799 2.001921 0.315434
O -0.994828 -2.239791 0.533740
C -2.293902 -0.301260 0.108161
C 0.249096 -0.241500 0.324768
C -3.354561 -0.382620 1.030893
C -1.013098 -1.038913 0.344072
C 1.459681 -0.937990 0.138052
C 0.257827 1.143358 0.511684
C 2.665703 -0.246825 0.123169
C -2.441522 0.442961 -1.071565
C 2.674313 1.167896 0.306182
C -4.548737 0.308607 0.759128
C 1.463534 1.848247 0.503286
C -3.218496 -1.175760 2.286642
C -3.634928 1.114512 -1.336765
C -4.687375 1.047452 -0.415625
C 3.957476 -2.269268 -0.180902
C 5.078809 1.421685 0.138500
H 1.419780 -2.022907 0.014463
H -0.676458 1.685919 0.671382
H -1.618035 0.492067 -1.785922
H 1.484757 2.927977 0.649314
H -5.372919 0.259807 1.468334
H -2.790758 -2.174962 2.081773
H -2.544061 -0.683476 3.001900
H -4.174981 -1.337628 2.798288
H -3.748099 1.686314 -2.255033
H -5.619942 1.573564 -0.618913
H 3.413806 -2.596150 -1.072238
H 3.569701 -2.739603 0.727805
H 5.034544 -2.448274 -0.288797
H 5.143252 0.928896 -0.837708
H 5.289598 0.716537 0.949440
H 5.721411 2.307722 0.191000


%chk=000269310-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269310

0 1
O 3.955003 -0.904680 -0.011525
O 3.930127 2.031865 0.140148
O -0.958407 -2.131260 0.769250
C -2.317745 -0.212495 0.215947
C 0.276757 -0.115675 0.338225
C -3.460909 -0.499215 1.030228
C -0.996106 -0.892151 0.466102
C 1.486438 -0.850001 0.210150
C 0.343744 1.300853 0.409831
C 2.736706 -0.211686 0.131278
C -2.449800 0.650090 -0.907034
C 2.798090 1.223283 0.198365
C -4.691528 0.118014 0.693331
C 1.588924 1.948063 0.345083
C -3.395206 -1.422216 2.234260
C -3.690637 1.232548 -1.238778
C -4.816917 0.969045 -0.427996
C 3.890818 -2.368293 -0.066923
C 5.302162 1.501684 0.019204
H 1.401424 -1.940722 0.187695
H -0.566954 1.890817 0.545209
H -1.575557 0.839720 -1.538917
H 1.668439 3.037319 0.410774
H -5.568310 -0.079762 1.321616
H -3.274198 -2.471565 1.914388
H -2.526851 -1.199215 2.879434
H -4.314002 -1.335990 2.839926
H -3.776365 1.881524 -2.116993
H -5.786744 1.420694 -0.665814
H 3.296963 -2.710549 -0.936016
H 3.460635 -2.786714 0.863019
H 4.935198 -2.696019 -0.175949
H 5.428081 0.933313 -0.916165
H 5.556894 0.857536 0.876197
H 5.932132 2.404637 0.012453


