%chk=000291939.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291939

0 1
O -0.007954 0.662195 2.134850
O 3.222096 -2.510509 -0.638887
C 0.153195 -1.390068 0.895826
C 1.398453 -2.280941 0.873458
C -0.571429 -1.391525 -0.464321
C 0.563257 0.035456 1.274066
C 1.732931 0.592449 0.518654
C 2.496043 -1.756310 -0.029031
C 2.652981 -0.269106 -0.106130
C -1.888169 -0.666727 -0.401329
C 1.908968 1.977064 0.444814
C 3.738584 0.265683 -0.808727
C -3.024260 -1.308270 0.114276
C -1.993314 0.654037 -0.861375
C 2.996763 2.506717 -0.261192
C 3.908193 1.653492 -0.887013
C -4.248113 -0.639786 0.167680
C -3.217140 1.323299 -0.809304
C -4.354956 0.681862 -0.294530
C -5.661004 1.404108 -0.222319
H -0.554746 -1.767542 1.679386
H 1.130528 -3.314939 0.565478
H 1.811296 -2.393714 1.900164
H -0.734288 -2.441228 -0.789883
H 0.081437 -0.951275 -1.246971
H 1.196161 2.637299 0.946949
H 4.448887 -0.411087 -1.293841
H -2.954262 -2.332072 0.477088
H -1.118090 1.164763 -1.259501
H 3.130839 3.587357 -0.317785
H 4.755201 2.065131 -1.436360
H -5.121952 -1.146043 0.572838
H -3.286206 2.348970 -1.166014
H -5.773073 2.145153 -1.024679
H -6.519629 0.723509 -0.292646
H -5.751727 1.943497 0.732812


%chk=000291939-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291939

0 1
O -0.079373 0.767735 2.048279
O 3.229933 -2.530850 -0.824634
C 0.187073 -1.375756 0.897467
C 1.438068 -2.289459 0.818610
C -0.605913 -1.407895 -0.461401
C 0.592160 0.056160 1.248259
C 1.811994 0.595581 0.554759
C 2.512695 -1.757996 -0.125904
C 2.708289 -0.270360 -0.143513
C -1.941625 -0.684052 -0.416200
C 2.057975 1.991110 0.571936
C 3.824475 0.275888 -0.825770
C -3.064925 -1.278658 0.212954
C -2.105638 0.597028 -0.998055
C 3.172013 2.524922 -0.106317
C 4.055392 1.665665 -0.810315
C -4.306986 -0.612076 0.262618
C -3.349819 1.263346 -0.950309
C -4.471718 0.674086 -0.314509
C -5.801282 1.404561 -0.233141
H -0.489025 -1.729953 1.696484
H 1.168022 -3.313031 0.503994
H 1.896488 -2.367290 1.826830
H -0.761404 -2.477612 -0.704499
H 0.031075 -0.988861 -1.263594
H 1.357942 2.631728 1.118430
H 4.496722 -0.411678 -1.349609
H -2.969200 -2.276535 0.660704
H -1.254389 1.075805 -1.498914
H 3.355845 3.604716 -0.093143
H 4.920407 2.083617 -1.336521
H -5.162658 -1.094920 0.750826
H -3.452388 2.252653 -1.413290
H -5.952180 2.070866 -1.100907
H -6.649767 0.698792 -0.192025
H -5.852776 2.033624 0.676920


