%chk=000249798.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249798

0 1
O -1.947384 1.192358 -0.691162
O 1.361482 -0.269478 -0.750612
O -3.317259 0.707976 1.047769
O 0.533106 0.551327 1.194462
O 3.319866 -1.546949 0.470334
C -1.039452 3.250785 0.196709
C 0.178111 3.470567 -0.710581
C -2.211845 2.628390 -0.550478
C 1.372556 4.001729 0.078182
C -1.953752 -1.029349 0.028444
C -0.575590 -1.294729 0.028155
C -2.496099 0.346483 0.240354
C -2.865005 -2.076528 -0.155835
C -0.110037 -2.602325 -0.169310
C -2.397482 -3.381104 -0.348683
C 0.433516 -0.228841 0.279747
C -1.024485 -3.643313 -0.357319
C 2.579283 0.482960 -0.566023
C 3.603803 -0.435807 0.097862
C 4.968897 0.165205 0.243128
H -1.353147 4.205903 0.659956
H -0.751878 2.586637 1.045485
H -0.077112 4.173185 -1.527083
H 0.442343 2.511547 -1.202423
H -2.293200 2.945007 -1.604590
H -3.174910 2.772807 -0.027357
H 2.246874 4.140791 -0.565154
H 1.650153 3.317280 0.890678
H 1.150121 4.971116 0.540298
H -3.937965 -1.872959 -0.141009
H 0.969772 -2.795202 -0.174328
H -3.109816 -4.194787 -0.490729
H -0.662225 -4.660714 -0.509736
H 2.861508 0.759372 -1.598431
H 2.387409 1.397897 0.032329
H 5.684554 -0.573009 0.640835
H 5.375366 0.528504 -0.708778
H 4.966823 1.011067 0.945296


%chk=000249798-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249798

0 1
O -1.846586 1.236291 -0.412185
O 1.512472 -0.485433 -0.976987
O -3.403008 0.493519 1.170091
O 0.598961 0.412586 0.973217
O 3.347324 -1.617591 0.746194
C -0.930736 3.420038 0.271442
C 0.123405 3.529920 -0.852564
C -2.199318 2.666957 -0.143172
C 1.415851 4.227454 -0.377985
C -1.936385 -1.105200 0.057078
C -0.568509 -1.387156 -0.224727
C -2.464535 0.263740 0.370133
C -2.887312 -2.152524 0.002953
C -0.186211 -2.700805 -0.595304
C -2.498717 -3.459817 -0.359285
C 0.515345 -0.387046 0.014496
C -1.147031 -3.731364 -0.670651
C 2.740030 0.262533 -0.695089
C 3.635721 -0.474840 0.318169
C 4.866979 0.295525 0.767214
H -1.234326 4.437041 0.596799
H -0.489033 2.913828 1.150378
H -0.308080 4.087120 -1.709376
H 0.355181 2.513997 -1.224667
H -2.613387 3.048412 -1.093855
H -2.976506 2.689249 0.640621
H 2.159953 4.302437 -1.192782
H 1.876372 3.671168 0.461227
H 1.207285 5.253095 -0.018858
H -3.930501 -1.922091 0.241100
H 0.870706 -2.903974 -0.788591
H -3.245962 -4.259268 -0.400552
H -0.838190 -4.743476 -0.952322
H 3.259406 0.348865 -1.665412
H 2.507127 1.274167 -0.311139
H 5.624608 -0.397573 1.164738
H 5.298831 0.902842 -0.048536
H 4.575676 0.991175 1.578589


