%chk=000218452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218452

0 1
O 4.647988 0.893971 -0.257229
O 4.817512 -1.979000 -0.348220
O 2.201597 1.950178 -1.163150
O -6.336535 -0.022418 0.560770
O -1.291242 -1.621661 1.389928
O 3.545065 0.392459 1.658344
N 2.563845 -2.063103 -0.541378
N 0.172660 -2.252983 -0.836035
N 1.216586 -0.107732 -1.004387
N -1.079254 -1.612160 -0.893285
C 3.745423 0.102345 -1.033513
C 3.813979 -1.360629 -0.593765
C 1.328218 -1.401099 -0.750007
C 2.330136 0.761167 -1.056280
C -2.766141 -0.157464 0.135095
C -1.663176 -1.143988 0.341670
C -4.076666 -0.517300 0.430014
C -2.442166 1.127529 -0.330410
C -5.085383 0.453883 0.245001
C -3.459684 2.068457 -0.496377
C -4.791752 1.743749 -0.215686
C 4.431327 1.006466 1.123845
C 5.451497 1.936409 1.661093
C -7.458048 0.886646 0.440767
H 4.198642 0.192338 -2.060386
H 2.596700 -3.056073 -0.279925
H 0.149559 -3.028248 -0.142214
H -1.167074 -1.012015 -1.733497
H -4.338560 -1.507034 0.802799
H -1.403590 1.393254 -0.543877
H -3.214709 3.071393 -0.850498
H -5.570512 2.487401 -0.353142
H 4.972354 2.838586 2.080535
H 6.169476 2.272456 0.892380
H 6.026326 1.462456 2.474675
H -7.582363 1.202670 -0.598710
H -7.333611 1.736669 1.117743
H -8.294025 0.249627 0.760711


%chk=000218452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218452

0 1
O 5.368563 0.507194 -0.613918
O 4.834216 -2.230189 0.049979
O 3.107131 2.159328 -0.868310
O -6.908782 -0.470090 0.166028
O -2.196774 -2.237940 0.398233
O 4.600487 0.575371 1.578799
N 2.553791 -1.799724 0.003903
N 0.236945 -1.365650 0.020862
N 1.626534 0.383795 -0.547705
N -0.829349 -0.474592 -0.109451
C 4.074778 -0.092828 -0.952961
C 3.898761 -1.450444 -0.237653
C 1.499165 -0.896914 -0.193187
C 2.897854 0.927753 -0.755901
C -3.251444 -0.058982 -0.008661
C -2.095128 -0.994671 0.111089
C -4.538339 -0.623237 0.122523
C -3.106298 1.338708 -0.238937
C -5.686947 0.195946 0.020671
C -4.256329 2.143693 -0.338100
C -5.551222 1.588211 -0.212683
C 5.494536 0.851128 0.749625
C 6.793687 1.567335 0.997968
C -8.135810 0.327757 0.077157
H 4.161995 -0.292173 -2.038426
H 2.400341 -2.710162 0.449830
H -0.076846 -2.313560 0.271819
H -0.523646 0.473511 -0.364122
H -4.643796 -1.696521 0.304833
H -2.122925 1.812119 -0.329393
H -4.150726 3.219678 -0.512428
H -6.427316 2.237953 -0.294335
H 6.718184 2.598159 0.607142
H 7.618716 1.067749 0.465076
H 6.999058 1.604417 2.077280
H -8.232018 0.808390 -0.915704
H -8.172405 1.098690 0.871099
H -8.954245 -0.392005 0.221356


