%chk=000230748.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230748

0 1
O 2.412387 0.000275 2.688739
O 2.412672 0.004138 -2.688437
C -0.243186 -0.000858 1.314431
C -0.243050 0.000202 -1.314419
C 1.141596 0.001155 0.676228
C 1.141670 0.001716 -0.676064
C -0.952649 -1.212993 0.711758
C -0.955776 1.209903 0.712742
C -0.952589 -1.212401 -0.712813
C -0.955700 1.210484 -0.711818
C 2.394840 0.002279 1.479633
C 2.394999 0.003863 -1.479331
C -1.557652 -2.240941 1.415440
C -1.563469 2.235699 1.417269
C -1.557529 -2.239761 -1.417402
C -1.563296 2.236868 -1.415571
C 3.659622 0.005095 0.667427
C 3.659692 0.005705 -0.666986
C -2.171562 -3.283600 0.695003
C -2.180075 3.277343 0.697692
C -2.171498 -3.283022 -0.697887
C -2.179981 3.277922 -0.695212
H -0.209639 -0.001283 2.421165
H -0.209384 0.000700 -2.421149
H -1.563480 -2.250632 2.503318
H -1.569345 2.244456 2.505152
H -1.563265 -2.248549 -2.505288
H -1.569033 2.246524 -2.503449
H 4.578805 0.006618 1.260578
H 4.578942 0.007641 -1.260036
H -2.650013 -4.096869 1.239015
H -2.660675 4.088909 1.242351
H -2.649894 -4.095842 -1.242617
H -2.660484 4.089954 -1.239261


%chk=000230748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230748

0 1
O 2.426134 0.002799 2.742228
O 2.426430 0.005113 -2.741921
C -0.238646 -0.000899 1.313094
C -0.238503 0.000244 -1.313082
C 1.156858 0.001196 0.687957
C 1.156933 0.001776 -0.687790
C -0.952647 -1.228416 0.709573
C -0.955849 1.225274 0.710641
C -0.952568 -1.227797 -0.710709
C -0.955775 1.225891 -0.709640
C 2.414554 0.002615 1.467963
C 2.414714 0.003504 -1.467658
C -1.568721 -2.269691 1.423881
C -1.574662 2.264302 1.425851
C -1.568559 -2.268455 -1.425988
C -1.574524 2.265532 -1.424015
C 3.687809 0.004619 0.683807
C 3.687884 0.005216 -0.683362
C -2.193003 -3.322480 0.705195
C -2.201725 3.316067 0.708081
C -2.192922 -3.321868 -0.708284
C -2.201657 3.316677 -0.705399
H -0.204150 -0.001327 2.412696
H -0.203886 0.000767 -2.412680
H -1.566056 -2.270995 2.519738
H -1.571994 2.264655 2.521708
H -1.565772 -2.268811 -2.521845
H -1.571746 2.266832 -2.519871
H 4.613500 0.005681 1.270401
H 4.613637 0.006831 -1.269856
H -2.675401 -4.141360 1.250333
H -2.686271 4.133202 1.253931
H -2.675260 -4.140274 -1.254184
H -2.686155 4.134279 -1.250593


