%chk=000179375.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179375

0 1
O -1.918474 -2.212971 -0.164245
O 2.348252 -0.198677 0.097164
O -2.939145 2.354380 1.203070
O -1.294317 -4.367589 -0.112252
O -4.980591 1.998575 0.518768
O 3.049295 1.309258 1.629416
O 4.386583 1.715556 -1.804780
C -1.061494 1.538215 -0.178485
C -1.879363 0.260861 -0.577067
C -1.305644 -0.931696 0.192751
C 0.194073 -1.141824 -0.145935
C 0.471799 1.326148 -0.118402
C 0.953883 0.007217 0.506627
C -1.543818 1.979641 1.223215
C -3.351538 0.406660 -0.278749
C 0.393211 -2.582666 0.224539
C -1.367622 2.636596 -1.184052
C -0.946810 -3.227613 -0.012053
C -3.842528 1.597659 0.468487
C -4.239887 -0.515051 -0.666257
C 1.489206 -3.208341 0.633504
C -1.004489 2.613347 -2.463420
C 3.317874 0.558716 0.723350
C 4.644091 0.258259 0.110599
C 4.704170 0.383008 -1.391254
C 5.679025 -0.075083 0.880804
H -1.762622 0.087130 -1.678729
H -1.489669 -0.828808 1.287374
H 0.364521 -1.074706 -1.258722
H 0.941997 2.178133 0.420513
H 0.898901 1.395152 -1.145023
H 0.922613 0.002995 1.615556
H -1.419473 1.194381 1.987147
H -1.062309 2.914001 1.572076
H -1.944582 3.473034 -0.774523
H -3.956498 -1.425493 -1.189878
H -5.305360 -0.430922 -0.468547
H 2.434906 -2.692312 0.772065
H 1.520908 -4.271135 0.852430
H -1.247372 3.410916 -3.154533
H -0.442480 1.815568 -2.928167
H 3.907759 -0.223569 -1.877445
H 5.691706 0.097019 -1.797872
H 6.667992 -0.289436 0.491524
H 5.618947 -0.156648 1.962339
H 5.027271 2.356615 -1.428030


%chk=000179375-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179375

0 1
O -1.970105 -2.293030 -0.162632
O 2.377721 -0.211679 -0.034705
O -2.914875 2.172695 1.386339
O -1.277298 -4.515979 0.090489
O -5.077030 1.535916 1.088635
O 3.031953 1.168855 1.731667
O 4.338110 0.967416 -2.220841
C -1.103555 1.503324 -0.272009
C -1.940742 0.202860 -0.604745
C -1.333942 -0.980641 0.163655
C 0.156479 -1.203021 -0.184925
C 0.436896 1.264459 -0.339775
C 0.949425 -0.021283 0.357094
C -1.465023 1.947407 1.174373
C -3.425278 0.384498 -0.288526
C 0.351965 -2.635277 0.267915
C -1.533541 2.611565 -1.236303
C -0.985546 -3.311643 0.081562
C -3.884841 1.361998 0.761466
C -4.381234 -0.355043 -0.912170
C 1.446598 -3.289056 0.723809
C -0.736053 3.351175 -2.044023
C 3.326675 0.501001 0.711170
C 4.701364 0.321954 0.136469
C 4.831687 -0.094355 -1.317137
C 5.771869 0.589188 0.934004
H -1.835601 -0.014972 -1.685143
H -1.457731 -0.843356 1.256711
H 0.244971 -1.187753 -1.293378
H 0.958694 2.142389 0.082645
H 0.738470 1.184368 -1.401150
H 0.906428 0.048280 1.460400
H -1.127948 1.214964 1.932118
H -1.004755 2.922362 1.402349
H -2.612879 2.820399 -1.243480
H -4.120896 -1.092741 -1.678242
H -5.435109 -0.235748 -0.639638
H 2.412797 -2.787220 0.831677
H 1.377029 -4.349319 0.993006
H -1.165388 4.128365 -2.685742
H 0.350474 3.223236 -2.100244
H 4.187335 -0.955828 -1.546793
H 5.885999 -0.352731 -1.543059
H 6.798597 0.474154 0.567844
H 5.633281 0.926208 1.967055
H 4.897452 1.776138 -2.092894


