%chk=000228035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228035

0 1
O 0.053784 1.671725 -0.285292
O 1.431730 -0.280361 2.411648
O 2.521620 2.605588 -0.478531
O -0.436694 -1.873636 1.638779
O 4.294379 2.556684 1.753594
O 4.767346 1.084447 -0.513009
N -1.704927 -0.325656 0.501712
C -2.749462 -1.295730 0.057730
C -2.564493 -1.640620 -1.434292
C -4.144620 -0.701981 0.337188
C -2.928626 -0.475706 -2.361745
C -4.507027 0.449017 -0.609146
C -4.345151 0.041590 -2.079437
C 1.109462 0.982847 0.409324
C 0.416478 0.347878 1.634378
C 2.179043 2.021631 0.804476
C -0.619248 -0.727557 1.234853
C 3.442125 1.439523 1.477964
C 4.191393 0.413491 0.613348
H -2.619967 -2.235621 0.665862
H -1.521587 -1.962390 -1.619878
H -3.196853 -2.518884 -1.672021
H -4.893051 -1.513504 0.238711
H -4.206319 -0.360557 1.388754
H -2.195354 0.345523 -2.244168
H -2.849470 -0.800939 -3.416665
H -5.549533 0.769942 -0.420322
H -3.877564 1.332999 -0.391547
H -4.570602 0.902473 -2.736313
H -5.086903 -0.739566 -2.335406
H -1.733991 0.611214 0.083577
H 1.527333 0.211727 -0.276648
H -0.043736 1.124634 2.289583
H 1.749929 2.826987 1.444572
H 3.179470 1.022972 2.485057
H 3.544185 -0.415612 0.280965
H 5.073010 0.001342 1.143313
H 0.447883 2.296699 -0.948603
H 1.251059 -1.273143 2.484660
H 3.059258 3.418479 -0.324862
H 4.991316 2.628721 1.048391
H 4.040575 1.446928 -1.090754


%chk=000228035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228035

0 1
O -0.214432 1.823457 0.129411
O 1.582520 -0.648507 2.234105
O 2.178900 2.911390 -0.199113
O -0.488611 -2.111003 1.656146
O 4.337463 2.629531 1.483801
O 4.500828 1.277533 -0.905617
N -1.730536 -0.392334 0.657030
C -2.863937 -1.244953 0.222739
C -2.607767 -1.840999 -1.190262
C -4.178597 -0.426873 0.246437
C -2.649710 -0.759973 -2.296209
C -4.232235 0.648234 -0.868374
C -3.984509 0.024201 -2.263583
C 0.948398 1.019585 0.567167
C 0.461317 0.126297 1.726827
C 2.056803 2.004020 0.984088
C -0.650338 -0.886406 1.316212
C 3.457008 1.443745 1.335749
C 4.069480 0.502350 0.278493
H -2.920164 -2.073894 0.951616
H -1.638700 -2.373238 -1.189094
H -3.393383 -2.598750 -1.387123
H -5.018158 -1.135569 0.101182
H -4.312531 0.034666 1.243223
H -1.805076 -0.053353 -2.157897
H -2.506938 -1.232667 -3.286636
H -5.214146 1.158018 -0.843299
H -3.471485 1.435126 -0.680621
H -3.985815 0.812707 -3.040549
H -4.818427 -0.667247 -2.505511
H -1.660942 0.588583 0.344103
H 1.294450 0.385869 -0.275211
H 0.051226 0.782597 2.523907
H 1.698658 2.604574 1.845841
H 3.402258 0.925067 2.304206
H 3.368982 -0.309910 0.012729
H 4.995917 0.052120 0.669171
H 0.157064 2.592717 -0.381852
H 1.224897 -1.590679 2.300819
H 2.826687 3.615387 0.074317
H 4.960958 2.603751 0.703569
H 3.698825 1.758429 -1.252139


