%chk=000288318.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288318

0 1
O -4.407124 -2.298197 0.461227
O -4.424382 2.275332 0.393523
O 4.406716 2.296044 -0.455424
O 4.422836 -2.277596 -0.395320
N -4.395054 -0.011628 0.409025
N 4.394077 0.009398 -0.407021
C -0.543939 0.004615 0.542782
C 0.542969 -0.006070 -0.540787
C -1.945886 -0.009081 -0.078981
C 1.944913 0.007249 0.080976
C -3.022631 0.002534 1.015466
C 3.021650 -0.003404 -1.013483
C -7.166599 -0.031247 -0.215839
C 7.165628 0.027257 0.217873
C -6.351471 -1.286885 -0.512744
C -6.360741 1.220942 -0.550264
C 6.350837 1.282631 0.516814
C 6.359432 -1.225255 0.550268
C -4.994474 -1.282368 0.153937
C -5.003927 1.246452 0.116318
C 4.993828 1.279560 -0.149848
C 5.002624 -1.249321 -0.116384
H -0.424194 0.899221 1.185340
H -0.417617 -0.871270 1.209424
H 0.416790 0.869955 -1.207272
H 0.423087 -0.900539 -1.183515
H -2.069013 -0.905194 -0.719168
H -2.075313 0.867771 -0.744119
H 2.067998 0.902865 0.721870
H 2.074382 -0.870118 0.745424
H -2.928005 0.913615 1.650470
H -2.920936 -0.888994 1.676595
H 2.926646 -0.913602 -1.649689
H 2.920320 0.889044 -1.673429
H -7.468931 -0.016387 0.852256
H -8.111121 -0.043416 -0.796015
H 8.110152 0.038233 0.798068
H 7.467956 0.014047 -0.850245
H -6.202308 -1.414781 -1.607493
H -6.900787 -2.199117 -0.190267
H -6.916893 2.138339 -0.255349
H -6.212231 1.317006 -1.648351
H 6.900395 2.195234 0.195801
H 6.201727 1.408800 1.611771
H 6.210874 -1.323049 1.648195
H 6.915341 -2.142325 0.253883


%chk=000288318-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288318

0 1
O -4.386310 -2.334900 0.349790
O -4.432874 2.326398 0.296228
O 4.390504 2.333569 -0.342282
O 4.426659 -2.327936 -0.299621
N -4.447116 -0.004134 0.382107
N 4.446118 0.002745 -0.380088
C -0.563966 0.013887 0.529099
C 0.562948 -0.010193 -0.527151
C -1.973460 -0.004532 -0.102177
C 1.972449 0.006632 0.104156
C -3.077533 0.015285 0.975939
C 3.076510 -0.012356 -0.973986
C -7.244651 -0.038763 -0.162705
C 7.243723 0.029827 0.164743
C -6.419756 -1.290179 -0.514400
C -6.445672 1.221639 -0.541194
C 6.421632 1.282250 0.519407
C 6.441946 -1.229668 0.540306
C -5.024355 -1.275520 0.101237
C -5.049624 1.248999 0.072881
C 5.026185 1.272185 -0.096241
C 5.045827 -1.252445 -0.073777
H -0.453547 0.919845 1.160365
H -0.450492 -0.859548 1.204217
H 0.450069 0.863775 -1.201680
H 0.451929 -0.915649 -1.159031
H -2.089462 -0.913678 -0.723189
H -2.095300 0.875274 -0.763239
H 2.089021 0.914774 0.726533
H 2.093733 -0.874242 0.763895
H -2.999147 0.932805 1.582643
H -2.990697 -0.873382 1.623329
H 2.996369 -0.928119 -1.583119
H 2.991405 0.878184 -1.619022
H -7.474011 -0.029673 0.919588
H -8.209564 -0.054208 -0.700044
H 8.208682 0.041888 0.702085
H 7.473032 0.022761 -0.917576
H -6.299790 -1.369632 -1.614439
H -6.905163 -2.222843 -0.181754
H -6.949997 2.150922 -0.227732
H -6.327937 1.280435 -1.642741
H 6.909131 2.214608 0.188969
H 6.301847 1.359358 1.619630
H 6.324138 -1.290812 1.641719
H 6.944167 -2.159337 0.224620


