%chk=000296798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296798

0 1
O -0.471972 -1.474908 -1.349586
O 1.477532 -0.694430 2.575171
C -0.098912 -0.481645 0.824482
C 1.279494 -0.376775 1.421575
C 2.362161 0.137161 0.535912
C -0.990496 0.499296 0.997324
C -2.365453 0.475257 0.460476
C -0.368585 -1.749630 0.055264
C 3.548719 0.592857 1.136169
C 2.230221 0.166452 -0.859833
C -2.677404 1.221317 -0.686550
C -3.361260 -0.275820 1.102868
C 4.587672 1.087699 0.346281
C 3.275236 0.657362 -1.647168
C -3.981139 1.208902 -1.189207
C -4.663153 -0.280188 0.595211
C 4.450281 1.120489 -1.046170
C -4.974343 0.458805 -0.550938
H -0.744662 1.406309 1.561690
H 0.470905 -2.472183 0.102406
H -1.295812 -2.243414 0.405012
H 3.647990 0.550536 2.224299
H 1.316182 -0.207230 -1.339448
H -1.907179 1.813423 -1.178432
H -3.119035 -0.847267 1.998182
H 5.504679 1.443384 0.812885
H 3.173534 0.675287 -2.731183
H -4.224285 1.788017 -2.079379
H -5.437649 -0.860951 1.095222
H 5.262126 1.504829 -1.663271
H -5.989490 0.452340 -0.944258
H -1.260404 -0.912283 -1.526304


%chk=000296798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296798

0 1
O -0.181326 -1.521161 -1.443955
O 1.046525 2.178095 1.220166
C -0.141337 0.289119 0.298952
C 1.123864 1.068144 0.595527
C 2.482202 0.564990 0.183858
C -1.318756 1.004577 0.399158
C -2.726175 0.607666 0.244459
C -0.103378 -1.197115 0.012591
C 3.602196 1.067946 0.904328
C 2.705102 -0.306134 -0.919024
C -3.702227 1.533233 0.730061
C -3.199855 -0.600479 -0.357650
C 4.912447 0.696670 0.547895
C 4.022506 -0.664444 -1.281799
C -5.080937 1.257621 0.655642
C -4.581151 -0.870937 -0.436409
C 5.127333 -0.172149 -0.550065
C -5.528213 0.048871 0.072121
H -1.171488 2.059452 0.678076
H 0.838779 -1.655893 0.348459
H -0.937898 -1.700396 0.537198
H 3.415056 1.757298 1.734094
H 1.862872 -0.698148 -1.500936
H -3.359311 2.472111 1.181240
H -2.506131 -1.328075 -0.788478
H 5.764855 1.083702 1.116914
H 4.184252 -1.328332 -2.138201
H -5.804651 1.982089 1.044241
H -4.921665 -1.800446 -0.905865
H 6.146508 -0.458891 -0.833281
H -6.599706 -0.168737 0.004401
H -0.714791 -0.817250 -1.895016


