%chk=Carbonate2.chk
%nprocshared=8
%mem=22GB
#p opt=(noeigentest) iop(1/8=10) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 3.01004800    9.36583700    1.65986100
 N                  2.33962900   11.32847400    1.13151700
 O                  4.47667500    9.65426000    0.68299700
 O                  1.49212800    8.71249400    0.99830600
 O                  3.14406100   10.20504700    3.47198600
 C                  3.48260900   12.28453500    1.13004900
 H                  3.92541600   12.26748000    2.12925500
 H                  3.09225800   13.29548700    0.96368500
 C                  4.53306800   11.96781100    0.10339700
 C                  4.98206500   10.65032400   -0.04186100
 C                  5.98930000   10.36173900   -0.98289400
 C                  6.51634700   11.39756100   -1.74368600
 H                  7.29275100   11.16719400   -2.46967000
 C                  6.07933200   12.71931500   -1.61437700
 C                  5.07924100   12.97990000   -0.68522900
 H                  4.70691500   13.99436100   -0.56596600
 C                  1.77068900   11.25386200   -0.24692800
 H                  2.54152400   10.82926500   -0.89460800
 H                  1.57585000   12.27364600   -0.59917500
 C                  0.51698700   10.43229600   -0.33701700
 C                  0.46702300    9.18291500    0.29056400
 C                 -0.70064200    8.40170800    0.18505900
 C                 -1.76922600    8.88683300   -0.55812200
 H                 -2.66656800    8.27738600   -0.63898600
 C                 -1.73490800   10.12981800   -1.19781600
 C                 -0.57985400   10.89096300   -1.06581000
 H                 -0.52161200   11.86718000   -1.54047700
 C                  1.28272300   11.83727500    2.03773100
 H                  0.47706500   11.09901800    2.05266100
 H                  0.86573700   12.75729700    1.61143500
 C                  1.70919800   12.10676500    3.45522300
 C                  2.56102600   11.26414900    4.15624300
 C                  2.81855300   11.43734400    5.51838300
 C                  2.22861900   12.52759500    6.15023100
 H                  2.42061200   12.67526500    7.20916000
 C                  1.39921300   13.42272800    5.47621900
 C                  1.14653200   13.18909600    4.13036900
 H                  0.49042600   13.85798200    3.58169000
 O                  3.56979800    7.85151800    2.38614500
 C                  3.92188100    7.34802600    3.61563200
 C                 -0.75490800    7.06962400    0.87649300
 H                  0.02472700    6.39779500    0.50458100
 H                 -0.58509700    7.17870400    1.95192800
 H                 -1.72455400    6.58925500    0.72666000
 C                  3.67335000   10.47284500    6.29385600
 H                  3.39257200    9.43574400    6.08768300
 H                  4.73326600   10.57802900    6.04969700
 H                  3.55484200   10.64839500    7.36381500
 C                  0.78747500   14.59317600    6.19856000
 H                  0.15834700   14.25695600    7.02820100
 H                  1.56060900   15.24296000    6.61911000
 H                  0.16910100   15.19412200    5.52871900
 C                 -2.91680000   10.61558200   -1.99728300
 H                 -3.14281200    9.93460500   -2.82419200
 H                 -3.81788700   10.68249200   -1.37913100
 H                 -2.72851900   11.60455800   -2.42188000
 C                  6.46193000    8.94403700   -1.13690000
 H                  6.87015500    8.55862200   -0.19742400
 H                  5.63713500    8.28020700   -1.41335100
 H                  7.23627900    8.87125500   -1.90375600
 C                  6.67787500   13.81357400   -2.46032700
 H                  7.74636100   13.93669200   -2.25596500
 H                  6.57627300   13.59348400   -3.52761400
 H                  6.18991600   14.77234100   -2.26939300
 H                  3.18490900    7.58928700    4.40223800
 C                  5.27373900    7.82527300    4.10718300
 O                  5.45196900    9.26381200    4.12886800
 H                  3.98065700    6.24941600    3.58053800
 C                  6.22172800    8.46330000    3.20110600
 H                  5.64860200    7.34360200    5.00694100
 H                  5.93504700    8.59615400    2.16288900
 H                  7.28194500    8.44546200    3.43151900
 H                  4.04539400    9.93062300    3.82256000
 C                  3.69403972    6.83921762    1.38379181
 O                  3.83697197    5.63368681    1.71520759
 O                  3.65572693    7.19807027    0.00008053






