%chk=000186299.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186299

0 1
O 1.949593 -0.790161 2.281323
C -0.618315 0.592870 -0.686676
C -1.976653 0.643411 -0.216992
C -2.869171 -0.410192 -0.551054
C 0.332327 1.684229 -0.351527
C 1.267255 1.393995 0.797029
C -2.394955 -1.508552 -1.355053
C -0.193403 -0.472548 -1.446487
C 2.413392 0.510643 0.392542
C -1.086045 -1.525150 -1.783460
C -2.451934 1.731175 0.584519
C -4.217561 -0.344695 -0.073863
C -3.318617 -2.625984 -1.723101
C 2.754761 -0.627238 1.171284
C -3.749832 1.764070 1.027260
C -4.646548 0.709886 0.692640
C 3.184262 0.780800 -0.738000
C 0.348056 2.836569 -1.025049
C 3.817592 -1.465658 0.824371
C 4.255726 -0.050407 -1.097381
C 4.566323 -1.165083 -0.320897
C 2.146960 -1.972386 3.092340
H 0.691404 0.918907 1.627851
H 1.669896 2.336679 1.226652
H 0.838264 -0.526533 -1.797827
H -0.707356 -2.346418 -2.389216
H -1.759975 2.536162 0.833862
H -4.905666 -1.149303 -0.328499
H -4.178032 -2.258830 -2.302289
H -2.826749 -3.393448 -2.335281
H -3.708969 -3.132738 -0.829049
H -4.112971 2.589924 1.636178
H -5.671614 0.757876 1.054482
H 2.945028 1.649520 -1.353743
H 1.029006 3.645614 -0.814087
H -0.325551 3.050628 -1.842325
H 4.071361 -2.334679 1.421009
H 4.841077 0.180406 -1.983772
H 5.397313 -1.811526 -0.600071
H 3.142087 -1.960090 3.545454
H 1.978079 -2.875101 2.498293
H 1.365355 -1.852543 3.854008


%chk=000186299-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186299

0 1
O 1.474843 -0.447763 2.316005
C -0.566941 0.818093 -0.994913
C -1.738155 0.565859 -0.184052
C -2.596484 -0.564728 -0.491259
C 0.390608 1.932359 -0.674419
C 1.304928 1.737347 0.539241
C -2.287595 -1.423080 -1.614082
C -0.309366 -0.022550 -2.084036
C 2.324110 0.612551 0.340995
C -1.160868 -1.127537 -2.388799
C -2.098817 1.428217 0.905122
C -3.752452 -0.791061 0.329313
C -3.163864 -2.615744 -1.954135
C 2.396451 -0.480813 1.252325
C -3.234282 1.182816 1.680107
C -4.065924 0.056600 1.394527
C 3.228639 0.631580 -0.743950
C 0.473827 3.039880 -1.460418
C 3.347750 -1.515778 1.074311
C 4.187702 -0.390410 -0.932112
C 4.242374 -1.464646 -0.018497
C 1.458015 -1.579535 3.242284
H 0.705817 1.504505 1.436160
H 1.841064 2.686662 0.733731
H 0.578754 0.159538 -2.698181
H -0.916032 -1.765273 -3.246633
H -1.478514 2.307531 1.108304
H -4.404747 -1.642067 0.107864
H -4.203583 -2.310900 -2.181045
H -2.770310 -3.147949 -2.836179
H -3.213331 -3.339729 -1.118222
H -3.494477 1.857053 2.503718
H -4.955442 -0.132154 2.006174
H 3.169398 1.463732 -1.456438
H 1.191093 3.841927 -1.245321
H -0.180979 3.176092 -2.328266
H 3.400266 -2.355929 1.773319
H 4.879015 -0.348990 -1.780498
H 4.976955 -2.267133 -0.150739
H 2.417678 -1.669439 3.788362
H 1.240839 -2.528362 2.714256
H 0.647237 -1.356668 3.951473


