%chk=000195129.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195129

0 1
O 2.571870 -0.494325 -0.027069
O -1.978215 -0.040759 -0.301655
O -0.411812 -1.084484 1.424151
O 2.561713 -3.168741 -1.269990
O -1.637954 -2.921336 -0.235519
O 0.156561 -2.762519 -3.191440
C 1.463657 -1.412158 0.033410
C -0.847878 -0.689087 -0.921187
C 0.188901 -0.562481 0.218915
C 1.551056 -2.160446 -1.312383
C -1.082657 -2.162469 -1.302708
C 0.232780 -2.838040 -1.758690
C 3.153497 -0.170562 1.268668
C -3.294051 -0.382221 -0.820797
C 4.116893 0.952627 0.998728
C -4.233069 0.592936 -0.164883
C 4.782462 1.032917 -0.232401
C -5.542382 0.191189 0.138533
C 4.363610 1.908763 1.994783
C -3.815654 1.899494 0.124045
C 5.691266 2.068238 -0.466106
C -6.429436 1.099931 0.721565
C 5.279346 2.937258 1.756757
C -4.705662 2.801019 0.713907
C 5.942935 3.019278 0.527974
C -6.013348 2.404007 1.010536
H 1.569906 -2.115186 0.892688
H -0.565991 -0.094158 -1.818970
H 0.450960 0.508231 0.391359
H 1.937533 -1.471337 -2.109326
H -1.838470 -2.271045 -2.122216
H 0.221685 -3.910757 -1.449778
H -1.297587 -0.634708 1.557969
H 2.463527 -3.749896 -0.487920
H -1.229916 -2.650923 0.641169
H 0.897530 -3.268955 -3.595447
H 3.678773 -1.070908 1.640980
H 2.349308 0.114189 1.971122
H -3.504212 -1.435204 -0.543562
H -3.293570 -0.264887 -1.919840
H 4.575702 0.287274 -1.003030
H -5.870998 -0.823820 -0.076922
H 3.847311 1.855127 2.950788
H -2.792493 2.198974 -0.107195
H 6.204806 2.132227 -1.424082
H -7.447079 0.789913 0.953774
H 5.474315 3.678118 2.530259
H -4.379426 3.814731 0.940757
H 6.653546 3.822964 0.345718
H -6.706590 3.108105 1.466561


%chk=000195129-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195129

0 1
O 2.666797 -0.382527 -0.156198
O -2.185645 -0.090678 -0.267295
O -0.258106 -0.374800 1.445866
O 2.601506 -2.719742 -1.659083
O -1.267914 -2.850347 0.446761
O -0.139338 -3.136937 -2.975811
C 1.420968 -1.160609 -0.139243
C -1.018298 -0.753276 -0.871656
C 0.162712 -0.277032 0.027415
C 1.395914 -1.909330 -1.481056
C -1.090429 -2.296075 -0.899695
C 0.191960 -2.865934 -1.569196
C 3.077231 0.085367 1.180009
C -3.493961 -0.458097 -0.866439
C 4.345599 0.909189 1.057283
C -4.541198 0.478279 -0.307518
C 4.738012 1.485787 -0.174967
C -5.528420 0.000011 0.588180
C 5.141168 1.132909 2.209395
C -4.544921 1.849374 -0.671014
C 5.907867 2.276321 -0.251255
C -6.509276 0.874805 1.109951
C 6.305761 1.928005 2.134381
C -5.519946 2.726026 -0.148857
C 6.694021 2.503054 0.901487
C -6.506762 2.239501 0.742092
H 1.448003 -1.892146 0.697319
H -0.884203 -0.390049 -1.912647
H 0.410230 0.774314 -0.218890
H 1.326885 -1.162872 -2.303052
H -1.940658 -2.649546 -1.508907
H 0.455577 -3.800260 -1.034997
H -1.162288 0.049870 1.482042
H 3.375003 -2.134882 -1.440943
H -0.969592 -2.167769 1.115550
H 0.661756 -3.532614 -3.404631
H 3.239041 -0.791441 1.843035
H 2.255643 0.686395 1.623299
H -3.728756 -1.510091 -0.614907
H -3.408154 -0.362026 -1.969518
H 4.128283 1.303571 -1.064625
H -5.527199 -1.057335 0.879710
H 4.851816 0.683477 3.168080
H -3.778578 2.226282 -1.358644
H 6.205126 2.714647 -1.210871
H -7.270000 0.493838 1.800247
H 6.911713 2.092654 3.032433
H -5.515505 3.783483 -0.435934
H 7.599926 3.116445 0.840512
H -7.266375 2.918909 1.144801


