%chk=000184999.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184999

0 1
O 0.455980 -1.716958 -1.059910
O 1.013907 -2.027587 2.566870
O -1.797019 -2.734338 2.146014
O -1.848414 -4.406879 -0.304221
O 0.170599 0.896892 0.074099
O 0.019368 -2.898579 -3.674456
O 3.962094 -1.855910 0.135046
O 4.558629 2.861136 -0.349752
O 2.405866 4.292380 -0.412347
O -4.438579 -0.751702 -0.140202
O -6.031176 1.484337 0.010692
C 0.287243 -1.762607 1.356159
C -0.685086 -2.955121 1.256846
C 1.260654 -1.729184 0.149869
C -1.339173 -3.077314 -0.136969
C -0.295874 -2.933718 -1.267606
C 2.087023 -0.485406 0.087851
C -0.950671 -2.720051 -2.641738
C 1.550405 0.804514 -0.014908
C 3.511342 -0.574937 0.024861
C 2.332589 1.962479 -0.163856
C 4.339890 0.539892 -0.108301
C 3.748713 1.810618 -0.212069
C 1.714175 3.278309 -0.288016
C -0.450535 2.144270 -0.091435
C 0.256680 3.282113 -0.257961
C -1.902408 1.953013 -0.042715
C 5.393948 -2.100941 0.054807
C -2.441592 0.648948 -0.076836
C -2.757963 3.070191 0.028263
C -3.819281 0.490363 -0.035558
C -4.142726 2.915793 0.048186
C -4.678604 1.621140 0.009276
C -4.478528 -1.486805 1.116138
H -0.263884 -0.800879 1.471303
H -0.180385 -3.903433 1.558059
H 1.903107 -2.644636 0.147396
H -2.179676 -2.350227 -0.238893
H 0.395090 -3.807070 -1.287169
H -1.402941 -1.715127 -2.726667
H -1.704379 -3.507614 -2.848467
H 1.732560 -1.367974 2.682220
H -1.460826 -2.639402 3.069157
H -2.519562 -4.594688 0.390980
H 5.422757 0.467017 -0.146505
H 0.738204 -2.232741 -3.569185
H -0.223152 4.253167 -0.390826
H 5.907670 -1.607103 0.884864
H 5.777199 -1.778858 -0.918447
H 5.433042 -3.194453 0.155005
H 4.017857 3.777766 -0.422903
H -1.783516 -0.225438 -0.147287
H -2.335528 4.078037 0.065221
H -4.811966 3.775094 0.089972
H -6.283511 0.511304 -0.090890
H -4.972944 -2.418671 0.820057
H -5.063669 -0.937922 1.856572
H -3.458620 -1.680898 1.480216


%chk=000184999-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184999

0 1
O 0.505808 -1.835763 -1.255365
O 0.817143 -2.087338 2.508849
O -1.695051 -3.382330 1.970552
O -1.838314 -4.667355 -0.609492
O 0.063367 0.888035 0.024587
O 0.350072 -2.849275 -3.868291
O 3.992012 -1.877984 0.154564
O 4.472984 2.958082 -0.080044
O 2.369798 4.356250 -0.205369
O -4.923333 -0.071546 1.039359
O -6.249130 1.950080 -0.066949
C 0.183085 -1.958206 1.186544
C -0.594741 -3.264225 0.995951
C 1.224814 -1.795341 0.047448
C -1.235630 -3.351124 -0.395242
C -0.160663 -3.145458 -1.477645
C 2.032777 -0.519143 0.100866
C -0.723322 -3.069288 -2.898915
C 1.472988 0.778369 0.032025
C 3.466609 -0.585353 0.103671
C 2.259691 1.958735 -0.037292
C 4.287867 0.563425 0.059437
C 3.690944 1.836771 -0.019541
C 1.637727 3.276259 -0.146521
C -0.556551 2.146392 -0.096687
C 0.193850 3.306615 -0.174090
C -2.025341 2.069889 -0.103955
C 5.451179 -2.043695 0.111912
C -2.704392 0.954853 0.471619
C -2.787170 3.126266 -0.675546
C -4.105729 0.929130 0.489170
C -4.194265 3.088597 -0.671388
C -4.861269 1.996120 -0.087383
C -4.275228 -1.174688 1.762565
H -0.511728 -1.099252 1.170508
H 0.109462 -4.114234 1.127090
H 1.925961 -2.652023 0.099831
H -2.002731 -2.549960 -0.484824
H 0.593516 -3.959286 -1.413587
H -1.482204 -2.258764 -2.948268
H -1.195753 -4.026685 -3.165795
H 1.349020 -1.272280 2.694936
H -1.292909 -3.327130 2.875346
H -2.391689 -4.873146 0.188240
H 5.377561 0.506559 0.068746
H 0.872413 -2.069494 -3.543711
H -0.298843 4.278810 -0.219164
H 5.930294 -1.570949 0.989379
H 5.870367 -1.622544 -0.820453
H 5.611353 -3.130847 0.138267
H 3.815805 3.778816 -0.142609
H -2.125817 0.140843 0.912605
H -2.281877 3.969463 -1.155024
H -4.787558 3.890281 -1.119047
H -6.531051 1.108113 0.383800
H -5.097366 -1.806587 2.127348
H -3.687205 -0.788122 2.615794
H -3.617205 -1.763737 1.101095


