%chk=000253627.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253627

0 1
O -3.190074 3.137172 -0.941972
O 3.014583 -2.013018 -2.438820
O -1.126247 2.507469 -0.856244
O 0.993199 -1.609154 -1.792884
O -6.463535 -1.720160 0.902478
O 6.550633 1.248420 1.406192
O -6.825784 0.269902 0.126304
O 6.718800 0.359386 -0.562933
N -2.322168 2.318206 -0.700467
N 2.204410 -1.532308 -1.668458
N -6.096616 -0.639597 0.475393
N 6.100493 0.656647 0.441616
C -0.372510 0.216138 0.119997
C 0.513103 -0.856323 0.767685
C -1.847781 -0.008321 0.213661
C 1.961373 -0.478220 0.632260
C -2.760790 1.004531 -0.178281
C 2.744755 -0.799369 -0.498637
C -2.380730 -1.229397 0.674731
C 2.570855 0.226881 1.689094
C -4.150088 0.802768 -0.095162
C 4.101703 -0.434590 -0.564437
C -3.750353 -1.442833 0.758596
C 3.907794 0.602063 1.634418
C -4.636215 -0.416131 0.377356
C 4.671508 0.263563 0.500867
H -0.104314 0.304823 -0.969685
H -0.108988 1.219668 0.540385
H 0.319013 -1.845671 0.287042
H 0.243504 -0.983428 1.838421
H -1.708478 -2.042366 0.960568
H 1.977656 0.490069 2.569423
H -4.849042 1.603390 -0.401668
H 4.709606 -0.699970 -1.448956
H -4.155145 -2.399865 1.116422
H 4.377870 1.156424 2.458796


%chk=000253627-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253627

0 1
O -3.299532 3.373058 -0.405564
O 3.306268 -2.400701 -2.269321
O -1.313057 2.563581 -1.168931
O 1.168063 -1.674069 -1.980671
O -6.518345 -1.818066 0.992027
O 6.567412 1.376402 1.543731
O -6.941373 0.329222 0.340768
O 6.882471 0.267958 -0.427721
N -2.459765 2.413599 -0.594677
N 2.416824 -1.707000 -1.648883
N -6.142665 -0.648064 0.599573
N 6.149020 0.662168 0.555037
C -0.382710 0.232313 -0.039576
C 0.498712 -0.856257 0.635033
C -1.883083 0.028247 0.118691
C 1.972420 -0.490942 0.549363
C -2.851694 1.049411 -0.135481
C 2.865663 -0.881205 -0.491335
C -2.403207 -1.224686 0.546575
C 2.530078 0.295673 1.594472
C -4.237484 0.850598 0.027275
C 4.230737 -0.526110 -0.498320
C -3.779761 -1.464461 0.699595
C 3.879348 0.688568 1.610237
C -4.683290 -0.414464 0.437014
C 4.714313 0.265606 0.553707
H -0.142222 0.265747 -1.118223
H -0.100167 1.228878 0.345159
H 0.316302 -1.830267 0.152648
H 0.226147 -0.941281 1.704192
H -1.711446 -2.042296 0.759985
H 1.876048 0.599321 2.418959
H -4.943442 1.662960 -0.162285
H 4.893210 -0.859055 -1.301243
H -4.162519 -2.438212 1.016269
H 4.294727 1.300625 2.415022


