%chk=000267838.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267838

0 1
O 0.008887 -0.258683 -0.007758
O -7.012563 0.226359 -0.014913
O -6.019608 -0.174798 -1.894184
O 6.522861 0.045561 -0.174331
N 4.563708 0.560056 0.936716
N -6.020552 -0.009030 -0.684954
C -2.335266 -0.450987 -0.049653
C -1.088344 -0.750833 -0.834894
C 1.294945 -0.430681 -0.478743
C -3.559421 -0.357780 -0.720913
C 3.609582 -0.000628 0.035652
C -2.284353 -0.281304 1.344156
C 2.253513 0.110966 0.392763
C -4.721249 -0.102100 0.021188
C 1.639302 -1.068623 -1.675819
C 3.983897 -0.640217 -1.163024
C -3.451329 -0.019787 2.067430
C -4.681380 0.070122 1.412314
C 2.999231 -1.161598 -1.997708
C 5.974833 0.553472 0.779469
C 6.703688 1.232292 1.905147
H -0.957270 -1.840501 -0.985503
H -1.058169 -0.218356 -1.804477
H -3.627580 -0.480015 -1.807246
H -1.317503 -0.348745 1.854829
H 1.926047 0.598353 1.304777
H 0.897331 -1.483085 -2.345357
H 5.040377 -0.725970 -1.436337
H -3.402627 0.114234 3.149107
H -5.604901 0.271893 1.965311
H 3.292994 -1.655375 -2.926525
H 4.172992 1.007841 1.769588
H 6.439460 2.293971 2.000955
H 7.791758 1.191781 1.721082
H 6.529607 0.747994 2.875251


%chk=000267838-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267838

0 1
O 0.032624 -0.133096 0.085909
O -7.191653 -0.528162 0.034628
O -6.038740 -1.253240 -1.793881
O 6.707431 0.020062 -0.261575
N 4.721915 0.390040 0.942134
N -6.093128 -0.743642 -0.608017
C -2.385346 -0.271515 -0.013235
C -1.090394 -0.514284 -0.769266
C 1.330406 -0.280571 -0.445915
C -3.607758 -0.611813 -0.634774
C 3.722156 -0.005360 0.008356
C -2.400293 0.288659 1.287394
C 2.372757 0.095675 0.427060
C -4.814251 -0.383190 0.056496
C 1.614082 -0.763175 -1.746239
C 4.027628 -0.486664 -1.295725
C -3.624743 0.507550 1.961891
C -4.850688 0.174060 1.353287
C 2.967238 -0.855664 -2.145430
C 6.114098 0.391313 0.791257
C 6.860924 0.888820 2.030251
H -1.005548 -1.585221 -1.050357
H -1.074784 0.087017 -1.703130
H -3.647994 -1.047769 -1.638419
H -1.448163 0.546269 1.757322
H 2.110079 0.462760 1.426129
H 0.821137 -1.061203 -2.436925
H 5.068225 -0.561530 -1.612058
H -3.620140 0.940524 2.967351
H -5.812129 0.331542 1.848345
H 3.199246 -1.226950 -3.149646
H 4.371043 0.715684 1.846175
H 6.585235 1.931631 2.274576
H 7.940337 0.848237 1.826834
H 6.642089 0.259006 2.912595


