%chk=000190592.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190592

0 1
O -2.676264 -1.461365 0.382524
O -3.583589 2.668403 -1.005479
O -4.269237 -0.589134 -1.606335
O 0.900885 1.637220 -1.255677
O 2.131821 -0.646133 -0.183781
O 3.855710 -1.652712 0.874692
C -1.881878 1.295040 0.202310
C -0.816130 0.199724 -0.172752
C -2.987752 1.382566 -0.921977
C -1.531452 -1.153442 -0.481370
C -3.521087 -0.357984 0.747591
C -2.677653 0.732145 1.375939
C -4.075113 0.325704 -0.536145
C 0.173172 0.016273 0.995901
C -0.050632 0.592666 -1.470692
C -1.248033 2.651305 0.463485
C 1.157651 -1.137089 0.807758
C -0.682927 -2.380286 -0.315128
C 0.533217 -2.393622 0.245218
C -2.683328 1.097022 2.650269
C 1.336347 -3.642613 0.386563
C 3.469793 -0.956569 -0.033413
C 4.231864 -0.298159 -1.143470
C 4.976564 0.967703 -0.650564
C 4.010095 1.940025 0.031978
C 6.132130 0.590922 0.278207
H -2.595551 1.227215 -1.949910
H -1.956164 -1.120572 -1.517970
H -4.278831 -0.840718 1.390347
H -5.064717 0.807724 -0.389924
H -0.396124 -0.168853 1.933531
H 0.733996 0.961113 1.154744
H -0.728853 1.028331 -2.231108
H 0.478575 -0.284825 -1.890242
H -0.613352 2.648068 1.355103
H -0.606557 2.955635 -0.384222
H -1.999270 3.439679 0.589103
H 1.712720 -1.351462 1.753596
H -1.160209 -3.296954 -0.665919
H -2.068431 1.893698 3.046298
H -3.300956 0.624071 3.401590
H -3.865234 2.989576 -0.122297
H -3.908432 -1.482597 -1.371594
H 1.687914 1.275558 -0.755412
H 1.288713 -4.272059 -0.512194
H 0.968460 -4.251797 1.226536
H 2.402992 -3.443590 0.584688
H 4.959594 -1.026501 -1.561145
H 3.549448 -0.030059 -1.979534
H 5.397660 1.467663 -1.560971
H 3.077473 2.062541 -0.543471
H 4.456836 2.936059 0.133826
H 3.736214 1.607887 1.040144
H 6.612258 1.480034 0.701550
H 6.905237 0.018948 -0.246199
H 5.793721 -0.029525 1.120804


%chk=000190592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190592

0 1
O -2.681591 -1.484234 0.596515
O -3.806044 2.628934 -1.012184
O -4.659310 -0.758065 -1.156519
O 0.950078 1.382934 -1.528199
O 2.256093 -0.724880 -0.333587
O 3.859560 -1.537706 1.160583
C -1.951908 1.316224 0.166119
C -0.912123 0.174726 -0.274209
C -3.203403 1.306710 -0.827249
C -1.677082 -1.166300 -0.490844
C -3.502877 -0.311937 1.021363
C -2.623432 0.834875 1.457200
C -4.228738 0.278994 -0.221954
C 0.155687 -0.049535 0.829574
C -0.240895 0.545272 -1.648482
C -1.271068 2.691745 0.272531
C 1.121339 -1.216984 0.569274
C -0.785704 -2.383475 -0.545826
C 0.496307 -2.429096 -0.093131
C -2.556966 1.356775 2.704493
C 1.355387 -3.670866 -0.191628
C 3.586386 -0.942718 0.095309
C 4.573835 -0.353175 -0.893708
C 5.255363 0.961203 -0.378290
C 4.217614 2.063993 -0.063198
C 6.189381 0.698302 0.825286
H -2.937275 1.008573 -1.852601
H -2.248719 -1.091593 -1.441711
H -4.172154 -0.720892 1.793564
H -5.134864 0.833078 0.089847
H -0.369037 -0.277671 1.775002
H 0.743442 0.869257 0.996086
H -0.939207 1.128160 -2.271022
H 0.007766 -0.389067 -2.194239
H -0.463959 2.680761 1.025914
H -0.822737 2.995510 -0.685411
H -1.995131 3.468974 0.573013
H 1.621741 -1.516689 1.510473
H -1.240456 -3.292076 -0.961273
H -1.932153 2.227164 2.934600
H -3.128517 0.925482 3.535123
H -4.079423 2.988833 -0.129211
H -4.285125 -1.620819 -0.826648
H 1.674843 0.793751 -1.176582
H 0.795062 -4.517812 -0.622223
H 1.737159 -3.969920 0.802895
H 2.243275 -3.490064 -0.827243
H 5.360280 -1.110282 -1.070115
H 4.057106 -0.153116 -1.847825
H 5.878832 1.311457 -1.226718
H 3.551386 2.266871 -0.921962
H 4.730021 3.008393 0.195206
H 3.586559 1.784059 0.802100
H 6.691688 1.634409 1.131059
H 6.970175 -0.043132 0.574103
H 5.626837 0.308583 1.691962


