%chk=000182939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182939

0 1
O -5.043483 -1.135112 -1.257147
O -0.699779 -1.296254 -1.205101
O 0.062582 -2.744763 0.314978
C -3.578655 -1.544868 0.517584
C -3.025173 -1.065897 1.861132
C -4.294578 -0.419397 -0.245515
C -2.251936 -2.182348 2.576334
C -3.340662 0.536214 -0.909889
C -1.739507 -1.726298 3.940069
C -2.960838 1.693838 -0.364348
C 2.747467 -2.551430 -0.792228
C -2.005392 2.638877 -1.033043
C 4.140511 -1.971985 -1.079226
C 1.636498 -1.563689 -1.164520
C 4.457412 -0.830305 -0.158157
C -0.914913 3.071516 -0.095306
C 4.909949 1.575494 0.347706
C 4.620731 0.427475 -0.577179
C 1.484821 3.434461 0.508837
C 0.382103 2.971308 -0.399251
C 3.838908 2.627119 0.247262
C 2.569738 2.400683 0.598519
C 0.319717 -1.969817 -0.579109
H -4.293338 -2.383837 0.659592
H -2.766352 -1.978290 -0.113638
H -3.852114 -0.710767 2.506153
H -2.360749 -0.191851 1.709452
H -5.035733 0.103307 0.401404
H -2.896187 -3.074521 2.696465
H -1.395684 -2.514340 1.946626
H -2.964944 0.195149 -1.876938
H -2.558863 -1.438484 4.607377
H -1.178178 -2.528064 4.434212
H -1.066122 -0.866503 3.850570
H -3.329225 2.023568 0.609106
H 2.612060 -3.498376 -1.350873
H 2.660344 -2.825520 0.281323
H 4.903458 -2.769057 -0.950569
H 4.212259 -1.667567 -2.142810
H -2.565659 3.537240 -1.381182
H -1.580589 2.187850 -1.956259
H -5.450223 -0.514286 -1.889271
H 1.888588 -0.539478 -0.796560
H 1.551071 -1.452748 -2.266512
H 4.529942 -1.103499 0.894878
H -1.259047 3.481802 0.853477
H 5.902497 2.006041 0.095092
H 5.002689 1.235279 1.401818
H 4.541217 0.705140 -1.628331
H 1.875480 4.404945 0.130598
H 1.107239 3.652428 1.531707
H 0.723618 2.548419 -1.345431
H 4.171637 3.589883 -0.136430
H 2.241868 1.430264 0.975058
H -1.612382 -1.495453 -0.791305


%chk=000182939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182939

0 1
O -5.125101 -1.038899 -1.115477
O 0.408761 0.232502 -1.065705
O 0.883720 -0.755940 0.980674
C -3.474913 -1.709907 0.501254
C -2.619221 -1.373226 1.741397
C -4.163786 -0.483048 -0.123137
C -1.933503 -2.618374 2.348990
C -3.214650 0.471206 -0.814720
C -1.033043 -2.270051 3.553532
C -3.087854 1.786591 -0.498605
C 2.338250 -2.901465 -0.560507
C -2.162688 2.767937 -1.200369
C 3.743583 -2.263888 -0.756441
C 1.178941 -2.044220 -1.117514
C 3.963701 -1.023947 0.085035
C -1.046152 3.274463 -0.296652
C 4.500603 1.419682 0.524180
C 4.322861 0.202716 -0.375036
C 1.385895 3.879239 0.238011
C 0.265302 3.359904 -0.653341
C 3.581776 2.574496 0.136284
C 2.337054 2.762102 0.647591
C 0.845141 -0.827025 -0.270679
H -4.269513 -2.431998 0.773969
H -2.851120 -2.199837 -0.273348
H -3.259002 -0.898618 2.515518
H -1.840841 -0.630926 1.477476
H -4.723842 0.065081 0.667750
H -2.706939 -3.355180 2.649542
H -1.318644 -3.109239 1.566626
H -2.622240 0.038807 -1.635632
H -1.614358 -1.771136 4.352694
H -0.570091 -3.175528 3.988406
H -0.222797 -1.588791 3.237020
H -3.682050 2.193135 0.336307
H 2.319133 -3.884219 -1.069575
H 2.162451 -3.088666 0.516315
H 4.498731 -3.030293 -0.482046
H 3.901631 -2.031273 -1.828497
H -2.763337 3.641347 -1.536101
H -1.732623 2.307192 -2.109015
H -5.506252 -0.282540 -1.631795
H 1.383658 -1.712770 -2.150210
H 0.255418 -2.658283 -1.155384
H 3.793002 -1.150895 1.165776
H -1.346613 3.605113 0.710295
H 5.553284 1.766640 0.479222
H 4.301972 1.119871 1.570032
H 4.473147 0.358847 -1.454573
H 1.953224 4.660158 -0.305886
H 0.949364 4.354976 1.137827
H 0.572969 3.035130 -1.659877
H 3.958146 3.276614 -0.624907
H 1.948440 2.042101 1.385194
H 0.185117 1.037827 -0.510689


