%chk=000192125.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192125

0 1
I 2.070856 -3.090141 -2.003146
I 2.968966 0.234091 3.123038
O -4.760831 -1.396987 -1.096736
O 3.535146 -1.882865 0.233607
O -1.974305 1.180695 0.985373
N 6.931421 1.621644 -0.198938
C -4.417708 0.977556 -1.219420
C -3.921861 -0.327630 -0.736476
C -2.812331 -0.761305 -0.043450
C -4.829689 1.882181 -0.044636
C -2.939271 -2.203901 0.093615
C -4.150628 -2.552294 -0.568039
C -5.366743 3.228670 -0.543654
C -1.745305 0.081735 0.513192
C -2.199848 -3.221714 0.703779
C -0.350167 -0.447023 0.480720
C 5.165346 -0.073579 0.125093
C 6.627550 0.292535 0.428258
C -4.648409 -3.847136 -0.666114
C -5.767421 4.130816 0.621238
C 4.787356 -1.385794 0.796702
C -2.680167 -4.529156 0.618063
C -3.879167 -4.838723 -0.054896
C 0.554842 -0.003065 1.452173
C 0.081221 -1.339191 -0.520133
C 2.325994 -1.312882 0.453025
C 1.396548 -1.759257 -0.528412
C 1.882047 -0.447859 1.464151
C 8.127090 2.241226 0.447504
C 7.153897 1.485549 -1.669124
H -5.278658 0.831663 -1.910327
H -3.626180 1.480821 -1.820285
H -5.590684 1.373194 0.577062
H -3.950522 2.043010 0.623209
H -6.236865 3.069798 -1.210086
H -4.598260 3.736934 -1.159401
H -1.274958 -2.996730 1.232729
H 4.999023 -0.151081 -0.969417
H 4.501308 0.753883 0.458845
H 6.759680 0.381986 1.529440
H 7.308700 -0.516132 0.088187
H -5.577666 -4.064854 -1.183522
H 5.447776 -2.226501 0.499199
H 4.721142 -1.334279 1.896106
H -6.558175 3.679093 1.230922
H -6.138031 5.098134 0.264637
H -4.917392 4.329893 1.285855
H -2.114979 -5.336635 1.083691
H -4.212517 -5.875496 -0.095523
H 0.197624 0.706413 2.214246
H -0.624898 -1.686056 -1.284169
H 7.906845 2.418515 1.512536
H 8.306913 3.228710 -0.008317
H 9.053971 1.654948 0.373368
H 7.280746 2.490676 -2.102866
H 8.021363 0.873080 -1.953755
H 6.254168 1.047716 -2.132118


%chk=000192125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192125

0 1
I 2.693915 -3.206325 -1.099835
I 2.758444 -0.102968 4.286095
O -4.340518 -0.955679 -1.432662
O 3.798523 -1.985827 1.666109
O -1.774421 1.212188 1.231852
N 6.569362 1.401959 -0.843275
C -3.849905 1.415938 -1.003858
C -3.502960 -0.018899 -0.792361
C -2.499543 -0.670798 -0.064192
C -4.939412 1.919243 -0.008980
C -2.730476 -2.114859 -0.220197
C -3.870457 -2.240966 -1.063383
C -5.302251 3.399753 -0.257675
C -1.503432 0.063213 0.744752
C -2.149276 -3.303872 0.291455
C -0.138478 -0.522985 0.984877
C 5.155026 -0.340911 0.305783
C 6.488261 0.440608 0.280986
C -4.446327 -3.455596 -1.452663
C -6.381972 3.911874 0.719685
C 5.007470 -1.099948 1.631178
C -2.710400 -4.544860 -0.079636
C -3.837904 -4.625586 -0.943404
C 0.567991 -0.114731 2.143769
C 0.483457 -1.408262 0.069074
C 2.536401 -1.441844 1.455839
C 1.798741 -1.848045 0.303260
C 1.867574 -0.590167 2.386988
C 7.711054 2.327560 -0.688830
C 6.567154 0.752661 -2.170368
H -4.209311 1.552671 -2.041955
H -2.941211 2.025928 -0.858957
H -5.845899 1.289848 -0.105800
H -4.554839 1.795776 1.020732
H -5.656481 3.523405 -1.301758
H -4.388036 4.018978 -0.158765
H -1.286243 -3.270060 0.962244
H 5.103089 -1.062192 -0.528905
H 4.329585 0.385381 0.182252
H 6.580102 1.024983 1.218555
H 7.343674 -0.288289 0.267053
H -5.321686 -3.490124 -2.106810
H 5.826982 -1.822437 1.782681
H 4.979978 -0.402642 2.489461
H -7.316004 3.327005 0.622028
H -6.626189 4.973240 0.530207
H -6.039195 3.825258 1.767619
H -2.267456 -5.468528 0.307781
H -4.245187 -5.605720 -1.212323
H 0.071660 0.566200 2.840727
H -0.047030 -1.726376 -0.831745
H 7.631920 2.859480 0.276162
H 7.688068 3.080968 -1.496253
H 8.708044 1.817237 -0.722939
H 6.607040 1.528077 -2.955789
H 7.435039 0.059767 -2.322743
H 5.637844 0.177195 -2.316540


