%chk=000271490.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271490

0 1
O 2.916965 1.901297 -0.397965
O -2.625714 -3.160366 -0.641832
O 3.983373 -2.765786 1.150950
C -1.063803 1.386380 -1.188479
C -0.525640 2.570739 -0.324322
C 0.702325 2.172978 0.534748
C -1.664160 3.111388 0.558302
C 0.108313 0.777971 -2.007859
C -1.759588 0.340098 -0.321265
C -2.196341 2.054419 1.530454
C -2.111538 1.910413 -2.193714
C -2.314995 0.678201 0.933652
C 1.243732 0.354715 -1.123282
C 1.772535 1.513749 -0.335821
C 1.294639 3.369526 1.276528
C -1.905028 -0.963006 -0.803275
C -2.988319 -0.298856 1.680392
C 1.672080 -0.911752 -1.033691
C -2.581547 -1.923039 -0.029941
C -3.131797 -1.608759 1.216183
C 2.751522 -1.401972 -0.194417
C 4.010942 -0.747655 0.100738
C 2.785072 -2.617815 0.456071
C -3.314089 -4.228697 0.050007
C 4.718095 -1.595157 0.906030
H -0.204148 3.384434 -1.020167
H 0.380685 1.400308 1.283355
H -2.488416 3.471960 -0.089917
H -1.319803 3.999562 1.122056
H 0.476367 1.525954 -2.742410
H -0.259167 -0.068550 -2.623676
H -3.183210 2.381995 1.918707
H -1.529960 1.998790 2.419004
H -2.984556 2.328922 -1.676614
H -1.703008 2.692650 -2.840392
H -2.482769 1.104995 -2.838221
H 1.559240 4.182722 0.589342
H 0.603269 3.766981 2.025796
H 2.224455 3.087956 1.791271
H -1.503193 -1.259317 -1.771173
H -3.413879 -0.037494 2.649882
H 1.173675 -1.695686 -1.619979
H -3.655530 -2.344464 1.814548
H 4.294282 0.227570 -0.267791
H 2.125013 -3.448115 0.561645
H -4.369635 -3.976364 0.185267
H -2.821203 -4.444971 1.002019
H -3.196878 -5.064095 -0.652387
H 5.669137 -1.591960 1.387242


%chk=000271490-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271490

0 1
O 2.937480 1.709542 0.323166
O -2.627591 -3.237450 -0.373527
O 4.419690 -3.203425 0.188378
C -1.065936 1.377935 -1.182237
C -0.595877 2.623678 -0.359153
C 0.578749 2.286432 0.620001
C -1.799682 3.234982 0.401116
C 0.182316 0.789316 -1.906139
C -1.788113 0.367081 -0.263660
C -2.370061 2.240556 1.436088
C -2.067869 1.805558 -2.301711
C -2.453252 0.801972 0.925868
C 1.350705 0.428182 -0.999978
C 1.737123 1.490508 -0.025411
C 1.107045 3.529130 1.367087
C -1.888427 -0.989977 -0.641904
C -3.187653 -0.144557 1.677503
C 1.954072 -0.804699 -1.125809
C -2.622307 -1.921619 0.125779
C -3.287597 -1.501027 1.301605
C 3.064053 -1.450755 -0.432225
C 4.108494 -0.948831 0.460051
C 3.309516 -2.821750 -0.564643
C -3.369869 -4.242372 0.388995
C 4.896184 -2.022132 0.810537
H -0.220710 3.375363 -1.086680
H 0.173470 1.568085 1.368982
H -2.582620 3.504660 -0.330733
H -1.506716 4.174292 0.903073
H 0.517006 1.569693 -2.623913
H -0.098486 -0.082854 -2.524806
H -3.372060 2.577924 1.765346
H -1.737812 2.257803 2.348825
H -3.033504 2.140484 -1.887900
H -1.643904 2.625628 -2.913071
H -2.278338 0.950047 -2.969491
H 1.368355 4.332915 0.653560
H 0.357534 3.924077 2.074458
H 2.022118 3.277653 1.927685
H -1.401246 -1.365151 -1.546618
H -3.699632 0.189601 2.589200
H 1.474727 -1.471257 -1.861528
H -3.868847 -2.196977 1.913494
H 4.236565 0.091347 0.745587
H 2.808383 -3.617907 -1.109799
H -4.448052 -3.993621 0.443620
H -2.963942 -4.353225 1.413669
H -3.235296 -5.182543 -0.166048
H 5.779618 -2.149515 1.428912


