%chk=000219941.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219941

0 1
O 4.754298 -0.641100 -0.595486
O -0.897963 -0.460345 2.423779
O -5.126494 0.754672 -0.035915
O -4.053356 -0.870863 -1.190089
C 1.557976 0.769146 0.444374
C 0.836586 -0.421385 0.793921
C 2.890542 0.652160 -0.030788
C -1.592249 -0.106576 0.157154
C -0.579887 -0.329407 1.264631
C 3.468415 -0.667749 -0.117831
C 1.438780 -1.657764 0.715990
C -2.969780 0.250545 0.705459
C 0.991664 2.076879 0.565049
C 2.769397 -1.799815 0.249596
C 3.621607 1.821140 -0.396257
C 1.717602 3.188934 0.210009
C 3.046391 3.063680 -0.282603
C -4.049313 -0.061994 -0.291836
C -6.332618 0.583695 -0.846196
C 5.460211 -1.902207 -0.720077
C -7.100671 -0.633206 -0.374820
H -1.233713 0.667882 -0.552350
H -1.650485 -1.035958 -0.460716
H 0.895404 -2.559091 1.010347
H -3.017042 1.316813 1.015818
H -3.170037 -0.318453 1.648829
H -0.017497 2.183902 0.960124
H 3.203169 -2.792120 0.197265
H 4.643221 1.697656 -0.763339
H 1.285967 4.185934 0.304798
H 3.594573 3.962013 -0.559385
H -6.854988 1.536332 -0.642889
H -6.034893 0.514401 -1.907545
H 6.432955 -1.574413 -1.110073
H 4.948645 -2.553463 -1.434718
H 5.568467 -2.374042 0.260999
H -8.082753 -0.700169 -0.857208
H -6.555764 -1.561129 -0.605709
H -7.261165 -0.613432 0.710886


%chk=000219941-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219941

0 1
O 5.013541 -0.397291 -0.370786
O -0.928831 -1.831742 1.761157
O -5.057137 0.934133 0.206934
O -4.243624 -0.561157 -1.391203
C 1.447666 0.522468 0.225745
C 0.890093 -0.762165 0.603646
C 2.856710 0.611365 -0.100351
C -1.622081 -0.478675 -0.122544
C -0.565204 -1.031070 0.845054
C 3.676065 -0.576385 -0.012672
C 1.748919 -1.866513 0.732658
C -2.897526 -0.020899 0.613269
C 0.692212 1.743890 0.233700
C 3.132208 -1.793225 0.421836
C 3.430693 1.868918 -0.470353
C 1.274804 2.963637 -0.120979
C 2.651238 3.027731 -0.493297
C -4.096591 0.062495 -0.313571
C -6.338839 1.051038 -0.557953
C 5.909219 -1.555910 -0.283091
C -7.315710 -0.055276 -0.150190
H -1.219441 0.305326 -0.782024
H -1.898659 -1.323645 -0.786734
H 1.317651 -2.818270 1.059969
H -2.765961 0.948781 1.125046
H -3.124427 -0.765026 1.403445
H -0.351193 1.729627 0.561557
H 3.747345 -2.692433 0.510850
H 4.494726 1.900839 -0.719303
H 0.674237 3.879681 -0.100664
H 3.097232 3.987501 -0.774832
H -6.709922 2.052532 -0.287506
H -6.108312 1.006187 -1.637014
H 6.890486 -1.183667 -0.610555
H 5.572683 -2.369887 -0.952892
H 5.976028 -1.928951 0.756459
H -8.283983 0.093725 -0.663389
H -6.925074 -1.046632 -0.434742
H -7.496043 -0.039955 0.938521


