%chk=000187354.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187354

0 1
O -0.042501 1.067410 0.192187
O 5.864485 2.126697 -0.423038
O -1.135876 2.374984 1.684311
O -0.769983 -2.038969 -0.854786
O -0.666756 -1.582686 1.335126
C 2.260507 1.155043 -0.369435
C 2.151816 -0.301900 -0.861818
C 3.667532 1.526715 0.125382
C 2.444841 -1.355329 0.211850
C 1.257427 1.450154 0.756698
C 2.403670 -2.776784 -0.365991
C 4.702569 1.489673 -0.998766
C 2.577337 -3.832758 0.720652
C -1.170135 1.530628 0.822815
C -2.363530 0.852875 0.234364
C -2.377415 -0.522648 -0.051732
C -3.498795 1.631524 -0.024839
C -3.515249 -1.108851 -0.618680
C -4.637454 1.039942 -0.581453
C -4.644087 -0.325094 -0.881516
C -1.202517 -1.385172 0.269551
H 1.995985 1.814972 -1.237201
H 1.120682 -0.451993 -1.254214
H 2.827383 -0.444296 -1.726020
H 3.990242 0.854157 0.945960
H 3.672893 2.544964 0.570956
H 3.432785 -1.168570 0.675015
H 1.703667 -1.267615 1.036823
H 1.222526 2.515804 1.041693
H 1.401288 0.822202 1.653002
H 3.184404 -2.897191 -1.142048
H 1.432397 -2.945260 -0.896016
H 4.387350 2.070747 -1.883432
H 4.965604 0.460095 -1.296391
H 1.799817 -3.751886 1.491941
H 3.543623 -3.731737 1.229520
H 2.530190 -4.846613 0.308623
H 6.618478 2.070652 -1.037191
H -3.491197 2.697964 0.216020
H -3.515505 -2.174049 -0.859148
H -5.520821 1.648033 -0.780764
H -5.530507 -0.783542 -1.321901
H 0.079228 -2.585291 -0.678307


%chk=000187354-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187354

0 1
O -0.064065 1.084054 0.049768
O 6.018142 2.192435 -0.294988
O -1.152910 2.212874 1.780429
O -1.508062 -2.731188 -0.416546
O -0.670046 -1.409633 1.295183
C 2.329684 1.204491 -0.465987
C 2.309343 -0.279896 -0.930928
C 3.700598 1.677690 0.090550
C 2.627506 -1.333732 0.154969
C 1.259758 1.506271 0.595554
C 2.535219 -2.777712 -0.391540
C 4.849799 1.538367 -0.911768
C 2.735932 -3.847805 0.703315
C -1.177122 1.422926 0.807845
C -2.424976 0.799760 0.246343
C -2.536681 -0.586581 -0.068249
C -3.522418 1.657784 0.002836
C -3.723245 -1.072999 -0.673794
C -4.705653 1.162711 -0.587435
C -4.800586 -0.202814 -0.940292
C -1.480804 -1.554346 0.350355
H 2.088233 1.826631 -1.354556
H 1.303563 -0.491599 -1.342202
H 3.018299 -0.400323 -1.775668
H 3.963153 1.122177 1.010960
H 3.636832 2.747233 0.372416
H 3.642490 -1.171990 0.572548
H 1.912253 -1.232852 0.993563
H 1.215596 2.583925 0.837041
H 1.421727 0.943591 1.533424
H 3.285589 -2.919582 -1.196434
H 1.543650 -2.913526 -0.874292
H 4.580304 2.034337 -1.870642
H 5.067056 0.469154 -1.118265
H 1.976745 -3.740090 1.501234
H 3.730124 -3.745516 1.177402
H 2.663751 -4.872583 0.293403
H 6.804342 2.090929 -0.888483
H -3.434050 2.714801 0.272898
H -3.792671 -2.137652 -0.912288
H -5.545331 1.840248 -0.774664
H -5.713023 -0.590407 -1.405088
H -0.811648 -3.352563 -0.070126


