%chk=000213686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213686

0 1
O -1.098340 -3.656719 1.864020
O 0.483010 -0.446393 -1.684087
O -3.141862 -3.020015 0.341907
O -1.316220 3.778115 -0.567732
O -0.259555 2.535112 0.855343
N 0.032593 -2.524954 0.119955
N 2.457089 1.416126 -1.375733
N -1.115190 2.723126 0.007605
C 1.151451 -1.623439 0.322479
C -1.004899 -2.418021 1.185461
C 1.303941 -0.601544 -0.612484
C 2.360134 0.376018 -0.463496
C 3.253450 0.235338 0.634385
C 2.071470 -1.746401 1.405091
C -2.340772 -2.116928 0.453607
C 3.095138 -0.847916 1.555084
C -2.568197 -0.753349 -0.088215
C 4.288244 1.215637 0.772300
C -1.742376 0.328186 0.240573
C -3.649786 -0.562266 -0.970469
C -1.998318 1.581633 -0.332260
C 4.378479 2.241177 -0.133437
C -3.891442 0.691957 -1.536243
C 3.427851 2.307731 -1.206459
C -3.063067 1.772831 -1.227585
H -0.769116 -1.673846 1.985073
H 0.355030 -3.503677 0.042399
H 1.937411 -2.569604 2.109551
H 3.801146 -0.937988 2.379274
H 4.987069 1.130113 1.604549
H -0.893679 0.220110 0.929434
H -4.298349 -1.414271 -1.208824
H 5.147371 3.007377 -0.057734
H -4.727600 0.827974 -2.224806
H -3.230157 2.761829 -1.671927
H 3.481796 3.127380 -1.934969
H -1.781031 -4.253395 1.445262
H -0.186618 -1.198343 -1.735794


%chk=000213686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213686

0 1
O -0.729194 -3.145473 1.881002
O 1.070188 0.076198 -1.719320
O -2.818257 -3.178477 0.194410
O -3.135724 3.981189 -0.707075
O -1.398291 3.047837 0.440325
N 0.090511 -1.832285 -0.038667
N 3.569694 1.297252 -1.335563
N -2.498878 2.968783 -0.225322
C 1.382302 -1.251656 0.279814
C -0.902432 -1.971252 1.037955
C 1.850466 -0.276646 -0.628959
C 3.125319 0.359013 -0.418329
C 3.881295 -0.010640 0.765084
C 2.137451 -1.598468 1.440327
C -2.291060 -2.034331 0.347627
C 3.365330 -0.982241 1.683392
C -2.948560 -0.792313 -0.155402
C 5.144239 0.640113 0.958515
C -2.379879 0.493037 0.029508
C -4.202739 -0.915408 -0.817952
C -3.083504 1.615211 -0.444900
C 5.587160 1.583626 0.030645
C -4.879394 0.224730 -1.294566
C 4.761290 1.879953 -1.101903
C -4.323524 1.509480 -1.110953
H -0.806172 -1.097904 1.702380
H 0.131718 -2.666547 -0.641338
H 1.733614 -2.356975 2.119419
H 3.951842 -1.244616 2.570953
H 5.747257 0.388037 1.838555
H -1.419003 0.650897 0.526204
H -4.623412 -1.918391 -0.943402
H 6.545877 2.097353 0.152371
H -5.841318 0.117851 -1.804921
H -4.822781 2.416123 -1.463098
H 5.087999 2.619288 -1.843138
H -1.330139 -3.859263 1.522245
H 0.206810 -0.424383 -1.604822


