%chk=000225064.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225064

0 1
O -3.412596 -0.714454 2.445203
O -4.397500 2.662616 -0.553282
O 7.148146 1.491512 1.758684
O 6.486930 1.850163 -0.347511
N -1.426645 -1.780800 0.323817
N -2.825224 1.125424 -1.231907
N -1.159324 -0.699740 -1.679376
N -3.907748 0.972352 0.952438
C 1.511879 -2.740557 -0.445526
C 2.283763 -1.426787 -0.622817
C 0.242826 -2.781035 -1.309473
C 3.544086 -1.396242 0.250964
C -0.761529 -1.762003 -0.901687
C 4.320890 -0.090117 0.048083
C -2.290937 -0.670421 0.335752
C -2.106426 -0.022224 -0.915201
C -3.204082 -0.217092 1.357168
C 5.566077 -0.041178 0.940141
C -3.761284 1.660515 -0.289376
C -2.626832 1.798224 -2.538442
C -4.892187 1.566523 1.899299
C 6.391411 1.174650 0.648170
H 1.257588 -2.891371 0.621007
H 2.159939 -3.597012 -0.722953
H 1.628883 -0.565996 -0.377498
H 2.555395 -1.289661 -1.688714
H 0.511059 -2.611289 -2.381376
H -0.209470 -3.795943 -1.281409
H 4.191576 -2.262231 0.010989
H 3.267266 -1.510152 1.317370
H 3.669261 0.781019 0.263501
H 4.618167 0.021172 -1.016453
H -1.332278 -2.425723 1.088866
H 5.286681 -0.064408 2.017078
H 6.198261 -0.944578 0.786671
H -3.294456 2.677728 -2.619168
H -2.850884 1.100417 -3.365046
H -1.579117 2.133142 -2.640538
H -4.928802 0.968165 2.829416
H -5.898475 1.585352 1.446160
H -4.606501 2.602534 2.151113
H 7.728013 2.285709 1.616664


%chk=000225064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225064

0 1
O -3.171966 -0.546603 2.572884
O -4.672326 2.574996 -0.640720
O 7.626549 1.101384 1.761184
O 6.302004 2.135379 0.159561
N -1.343493 -1.628914 0.303103
N -3.042613 1.028578 -1.321897
N -1.332280 -0.714307 -1.776886
N -3.912520 1.015942 0.937546
C 1.518937 -2.680151 -0.526112
C 2.310670 -1.355836 -0.602782
C 0.232764 -2.686017 -1.398067
C 3.588343 -1.375802 0.264879
C -0.798675 -1.681005 -0.974599
C 4.404710 -0.069019 0.155991
C -2.271675 -0.582607 0.329287
C -2.240723 -0.043858 -0.964157
C -3.111464 -0.093524 1.387705
C 5.671990 -0.101476 1.030580
C -3.918980 1.598482 -0.364737
C -2.994932 1.579135 -2.690072
C -4.837406 1.637627 1.912982
C 6.512531 1.154323 0.905022
H 1.262740 -2.898804 0.532079
H 2.165646 -3.514655 -0.862263
H 1.662710 -0.513014 -0.287811
H 2.584217 -1.156487 -1.659006
H 0.488294 -2.457344 -2.447053
H -0.211687 -3.701761 -1.387485
H 4.222893 -2.235323 -0.038225
H 3.308058 -1.553609 1.324591
H 3.776409 0.793337 0.450476
H 4.691310 0.109449 -0.897925
H -1.125735 -2.230714 1.096929
H 5.419269 -0.237113 2.100242
H 6.315433 -0.964165 0.765903
H -3.693907 2.426888 -2.731612
H -3.289675 0.806817 -3.420336
H -1.971518 1.915051 -2.926170
H -4.722662 1.095304 2.862977
H -5.875553 1.566410 1.549502
H -4.589863 2.703801 2.042620
H 8.159976 1.935409 1.652673


