%chk=000292938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292938

0 1
O 5.200748 -0.015692 -0.636099
O 4.554508 -1.516495 0.884942
O -5.272741 -0.456012 -0.582075
O -3.867811 -0.512801 -2.321540
N 0.706032 0.386363 0.065902
C 1.741021 -0.415514 0.574809
C 1.244566 1.279696 -0.915863
C 2.920294 -0.028179 -0.080385
C -0.675687 0.322178 0.459941
C 2.600402 1.028294 -1.002392
C 1.546089 -1.460964 1.593717
C 0.410616 2.258475 -1.639430
C -1.653764 0.014877 -0.497457
C -1.031940 0.572996 1.798310
C -2.997305 -0.036186 -0.099483
C 4.224192 -0.611818 0.140447
C -2.374152 0.507352 2.175431
C -3.361565 0.204575 1.232499
C -4.013320 -0.351453 -1.132033
H 3.321188 1.513757 -1.634838
H 1.354477 -1.043171 2.592752
H 0.721895 -2.146482 1.349433
H 2.465869 -2.079969 1.689541
H 1.026246 3.079474 -2.041171
H -0.105003 1.798321 -2.497540
H -0.356535 2.719118 -0.999906
H -1.379514 -0.185347 -1.539232
H -0.262991 0.822631 2.532282
H -2.655415 0.697905 3.212587
H -4.415225 0.154111 1.524165
H 6.092562 -0.425879 -0.480442
H -5.965039 -0.669360 -1.267171


%chk=000292938-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292938

0 1
O 5.239086 -0.022840 -0.681683
O 4.550670 -1.575980 0.901320
O -5.316717 -0.494834 -0.605754
O -3.762883 -0.731820 -2.316137
N 0.725317 0.400481 0.059743
C 1.745535 -0.419672 0.564163
C 1.254701 1.311949 -0.901268
C 2.936634 -0.023671 -0.084511
C -0.657345 0.335347 0.457314
C 2.618155 1.059409 -0.989321
C 1.501042 -1.518248 1.557466
C 0.408966 2.346762 -1.587225
C -1.645073 -0.030945 -0.479881
C -1.025331 0.647700 1.789844
C -3.005576 -0.078014 -0.086805
C 4.247756 -0.628436 0.123571
C -2.380887 0.584585 2.181114
C -3.376365 0.226558 1.247647
C -4.010808 -0.461852 -1.116672
H 3.331444 1.583128 -1.621056
H 1.286655 -1.129823 2.571585
H 0.645161 -2.153058 1.261577
H 2.408192 -2.138253 1.624297
H 1.062059 3.013013 -2.174248
H -0.329958 1.906717 -2.283121
H -0.151926 2.971493 -0.866238
H -1.376087 -0.294421 -1.507596
H -0.251235 0.948808 2.503202
H -2.659178 0.825896 3.211998
H -4.430228 0.181320 1.534314
H 6.102175 -0.480539 -0.493452
H -5.941252 -0.755959 -1.334489


