%chk=000228550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228550

0 1
O 1.418290 -0.007108 0.827589
O 0.897998 1.489831 -0.777802
O -1.416886 0.005183 0.830343
O -0.899711 -1.487474 -0.780017
C 0.771302 0.111214 -0.442901
C -0.772355 -0.109756 -0.441702
C 1.209897 -1.255892 1.564096
C 2.263350 2.023266 -0.814091
C -1.207031 1.251997 1.569765
C -2.265140 -2.020788 -0.815076
C 2.014606 -1.012227 2.835343
C 1.703628 -2.446071 0.751305
C 2.026448 3.526481 -0.738884
C 2.933131 1.582245 -2.110788
C -1.702295 2.444339 0.761090
C -2.009290 1.004969 2.841909
C -2.937419 -1.576312 -2.109298
C -2.028124 -3.524201 -0.744322
H 1.289286 -0.534847 -1.179159
H -1.291763 0.538261 -1.175234
H 0.114145 -1.331385 1.766241
H 2.803319 1.641681 0.081042
H -0.110888 1.326925 1.769989
H -2.803363 -1.641570 0.082111
H 3.085016 -0.912606 2.618211
H 1.701637 -0.077206 3.317719
H 1.885029 -1.829074 3.551099
H 2.690208 -2.256746 0.315707
H 1.006206 -2.669057 -0.071962
H 1.780225 -3.347020 1.367479
H 1.421894 3.878561 -1.584016
H 1.476275 3.785422 0.175393
H 2.969620 4.080992 -0.740078
H 2.271997 1.745334 -2.971242
H 3.186992 0.516810 -2.092815
H 3.858142 2.138732 -2.293846
H -2.689716 2.256191 0.326892
H -1.006453 2.669494 -0.062922
H -1.777683 3.343650 1.379801
H -3.080117 0.905935 2.626577
H -1.695406 0.068669 3.321199
H -1.878321 1.819914 3.559577
H -2.277947 -1.737109 -2.971456
H -3.191237 -0.510928 -2.087995
H -3.862785 -2.132307 -2.292053
H -1.425210 -3.874043 -1.591550
H -1.476195 -3.785579 0.168202
H -2.971309 -4.078691 -0.745169


%chk=000228550-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228550

0 1
O 1.405709 -0.015800 0.998908
O 0.912437 1.520747 -0.690232
O -1.403807 0.013410 1.001988
O -0.914149 -1.518510 -0.692375
C 0.766617 0.138079 -0.303939
C -0.767523 -0.136890 -0.302659
C 1.425390 -1.399391 1.564068
C 2.321389 1.989308 -0.869227
C -1.422340 1.395392 1.571105
C -2.323480 -1.986442 -0.870026
C 1.947850 -1.218413 2.993688
C 2.303635 -2.346656 0.723748
C 2.223205 3.517241 -0.914896
C 2.939453 1.390285 -2.146390
C -2.301649 2.345348 0.734946
C -1.942645 1.210359 3.000995
C -2.943472 -1.384598 -2.144926
C -2.225716 -3.514297 -0.919091
H 1.238477 -0.545066 -1.043761
H -1.241023 0.548208 -1.039625
H 0.382695 -1.768716 1.582205
H 2.893669 1.666097 0.021502
H -0.379537 1.764440 1.588650
H -2.894232 -1.665002 0.022325
H 2.976116 -0.813409 2.982532
H 1.303614 -0.515157 3.549230
H 1.956282 -2.186469 3.526868
H 3.320895 -1.930367 0.603435
H 1.865060 -2.529666 -0.272672
H 2.387679 -3.324881 1.232861
H 1.605355 3.838580 -1.772828
H 1.758466 3.898965 0.010212
H 3.227583 3.966617 -1.017747
H 2.339782 1.668767 -3.031602
H 3.000085 0.288166 -2.096688
H 3.967272 1.773671 -2.284895
H -3.319099 1.929518 0.614646
H -1.864334 2.531521 -0.261433
H -2.384969 3.321941 1.247301
H -2.971135 0.805909 2.990207
H -1.297927 0.505091 3.553420
H -1.949761 2.176799 3.537115
H -2.345534 -1.661715 -3.031738
H -3.003351 -0.282539 -2.092993
H -3.971766 -1.767102 -2.282356
H -1.609207 -3.833945 -1.778620
H -1.759713 -3.898112 0.004513
H -3.230351 -3.963216 -1.021446


