%chk=000180444.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180444

0 1
O -1.050564 2.028133 -0.084946
O -5.070160 -0.432225 -0.374209
O -3.378735 -2.847236 -0.290813
O 0.599842 3.266478 -0.792604
O 3.071883 2.365707 -0.267109
O 3.473940 -2.442363 0.239192
C -1.585781 0.806297 0.503672
C -3.067933 0.885489 0.097335
C -0.873800 -0.403564 -0.085363
C -3.745874 -0.480864 0.188307
C -3.026280 -1.517523 -0.708590
C -1.529390 -1.457637 -0.587668
C -1.376994 0.884557 2.012845
C 0.598857 -0.302747 -0.063953
C 1.162850 0.994787 -0.191488
C 0.306154 2.171962 -0.383650
C 1.406448 -1.421503 0.084551
C 2.568054 1.109756 -0.166115
C 2.813578 -1.258392 0.095219
C 3.416597 -0.004265 -0.025252
C 4.925568 -2.428853 0.264000
H -3.135417 1.285885 -0.940251
H -3.590406 1.638988 0.716396
H -3.829805 -0.845108 1.236250
H -3.343009 -1.383068 -1.774424
H -1.019762 -2.351902 -0.961313
H -1.761250 1.832858 2.412379
H -1.877470 0.063404 2.537056
H -0.312118 0.845067 2.279108
H 0.990917 -2.420655 0.202551
H -5.593066 0.293641 0.016952
H -4.353897 -2.965421 -0.374561
H 4.490238 0.119615 -0.014067
H 4.066099 2.385941 -0.259563
H 5.283597 -1.852377 1.121636
H 5.316312 -2.047049 -0.683566
H 5.154078 -3.497112 0.383156


%chk=000180444-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180444

0 1
O -1.056229 2.094642 -0.244712
O -5.166217 -0.565501 -0.128335
O -3.447121 -2.918027 -0.369551
O 0.745967 3.348290 -0.839022
O 3.198113 2.385740 -0.078684
O 3.489444 -2.513907 0.180291
C -1.615556 0.856372 0.414843
C -3.109658 0.867491 0.024331
C -0.890856 -0.364775 -0.147189
C -3.736119 -0.523238 0.231297
C -3.068628 -1.536575 -0.705363
C -1.565164 -1.442383 -0.637851
C -1.409930 1.006317 1.939881
C 0.589199 -0.271433 -0.110248
C 1.185089 1.035112 -0.170349
C 0.345973 2.240826 -0.427495
C 1.388217 -1.423997 0.008279
C 2.605488 1.124421 -0.075169
C 2.796001 -1.308068 0.067961
C 3.410895 -0.035920 0.037230
C 4.953579 -2.466394 0.255570
H -3.195484 1.153316 -1.039935
H -3.639849 1.633260 0.621056
H -3.604069 -0.866520 1.279292
H -3.414022 -1.299529 -1.738762
H -1.028225 -2.304705 -1.051336
H -1.824073 1.974574 2.270681
H -1.922053 0.192798 2.484401
H -0.340886 0.974562 2.209520
H 0.941887 -2.418000 0.090149
H -5.684133 0.007385 0.490446
H -4.438339 -2.957489 -0.398933
H 4.499371 0.069062 0.107720
H 4.184321 2.310015 -0.015773
H 5.290724 -1.911010 1.151992
H 5.386736 -2.011217 -0.655772
H 5.268908 -3.516797 0.330642


