%chk=000205831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205831

0 1
O 1.874130 0.540670 -0.628963
O 3.582409 1.993050 -0.355054
O -0.881567 0.170531 0.430310
O -0.850990 1.205013 -1.589708
C 3.403425 -1.301341 -0.168808
C 2.327102 -2.048565 0.641210
C 4.462916 -2.221902 -0.804867
C 1.635168 -3.187734 -0.116486
C 2.762164 -0.435089 -1.264655
C 0.509149 -3.810183 0.721224
C 5.299101 -2.953205 0.241675
C -0.186735 -4.948973 -0.018741
C 2.411089 1.726633 -0.202975
C 1.378125 2.573145 0.459046
C -0.002869 2.333223 0.397584
C 1.854935 3.675258 1.189131
C -0.895394 3.173823 1.075373
C 0.963504 4.516687 1.858148
C -0.589850 1.216816 -0.410613
C -0.410612 4.264098 1.804328
C -1.492785 -1.019710 -0.161933
C -2.986717 -0.879767 -0.122379
C -3.729659 -1.496211 0.893794
C -3.642051 -0.128415 -1.110011
C -5.122066 -1.369637 0.914498
C -5.032648 -0.003364 -1.083785
C -5.774349 -0.625417 -0.073312
H 3.929101 -0.606968 0.539772
H 2.785571 -2.444296 1.567922
H 1.567015 -1.305757 0.970088
H 5.135019 -1.618487 -1.448975
H 3.978547 -2.956213 -1.477299
H 2.374110 -3.967308 -0.386232
H 1.227862 -2.814178 -1.075417
H 2.049735 -0.984753 -1.904773
H 3.506926 0.102789 -1.876533
H 0.913429 -4.178698 1.683913
H -0.237315 -3.024803 0.987799
H 4.682774 -3.614381 0.862362
H 6.070307 -3.571615 -0.231615
H 5.808126 -2.252644 0.914146
H 0.512535 -5.757109 -0.263636
H -0.633331 -4.609494 -0.960228
H -0.989241 -5.385249 0.586673
H 2.932824 3.867303 1.223987
H -1.968528 2.975244 1.035345
H 1.341528 5.369976 2.421995
H -1.107964 4.917356 2.330497
H -1.103052 -1.158807 -1.188694
H -1.092881 -1.823850 0.501404
H -3.226144 -2.070151 1.669775
H -3.056836 0.362866 -1.893150
H -5.698171 -1.850644 1.702959
H -5.539294 0.579026 -1.851782
H -6.858378 -0.528989 -0.055936


%chk=000205831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205831

0 1
O 2.464956 0.638871 0.022617
O 2.446194 2.317260 -1.600664
O -1.483619 0.109088 1.359526
O -0.276790 0.163385 -0.639953
C 3.886380 -1.362102 -0.047599
C 2.809401 -2.197904 0.699229
C 4.815697 -2.203019 -0.969674
C 1.822835 -2.986958 -0.193304
C 3.278795 -0.225396 -0.883787
C 0.826871 -3.824318 0.642847
C 5.591612 -3.313931 -0.230691
C -0.187626 -4.600527 -0.224679
C 2.038811 1.847980 -0.511635
C 1.120338 2.571486 0.434200
C -0.070372 1.998397 0.967624
C 1.486102 3.887160 0.803389
C -0.843953 2.738701 1.898268
C 0.708296 4.618076 1.727080
C -0.579710 0.685169 0.462134
C -0.453700 4.037242 2.284845
C -2.161281 -1.162078 0.905999
C -3.462950 -0.867968 0.194544
C -4.684992 -0.846914 0.913658
C -3.476614 -0.615100 -1.202326
C -5.902578 -0.573309 0.251569
C -4.693033 -0.339750 -1.864401
C -5.908278 -0.318909 -1.139841
H 4.525910 -0.889174 0.728145
H 3.322315 -2.905452 1.381480
H 2.230592 -1.509182 1.344920
H 5.543622 -1.519238 -1.452703
H 4.222312 -2.650560 -1.792005
H 2.373958 -3.669078 -0.872546
H 1.251856 -2.286702 -0.835322
H 2.601360 -0.594977 -1.675667
H 4.060317 0.398527 -1.355191
H 1.393089 -4.536000 1.278467
H 0.287660 -3.152570 1.342295
H 4.914424 -4.088116 0.172714
H 6.303451 -3.815858 -0.911316
H 6.169539 -2.897573 0.616032
H 0.331683 -5.293141 -0.913811
H -0.792567 -3.910986 -0.844411
H -0.882317 -5.198121 0.394321
H 2.387447 4.326748 0.364635
H -1.758616 2.288386 2.292329
H 1.007790 5.633206 2.008542
H -1.060949 4.598772 3.002486
H -1.453461 -1.707477 0.259894
H -2.319573 -1.702370 1.852390
H -4.681130 -1.045253 1.992714
H -2.531307 -0.624132 -1.756337
H -6.842211 -0.561906 0.815078
H -4.694616 -0.144340 -2.942408
H -6.852169 -0.108468 -1.655298


