%chk=000275381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275381

0 1
O -4.232358 -1.220702 2.225912
O -0.568073 2.611292 -0.995640
O -3.501310 0.093454 0.534270
O -0.038448 2.759900 -3.191799
N 3.953715 -1.955529 0.641201
N 3.259696 -3.156982 0.658277
C 2.966281 -0.793194 0.748367
C 1.581463 -1.486401 0.520976
C 3.308836 0.234830 -0.337793
C 0.546555 -1.139056 1.595776
C 2.377780 1.449581 -0.263342
C 1.975495 -2.959884 0.522266
C -0.882656 -1.238806 1.049933
C 2.636527 2.432769 -1.411694
C 5.083271 -1.919252 1.608071
C -1.917518 -0.890243 2.126277
C 1.547922 3.511541 -1.485943
C -3.251722 -0.594122 1.499017
C 0.267677 2.937971 -2.036504
C -5.623895 -1.069842 1.795086
C -1.898795 2.083659 -1.313980
C -5.892348 -1.963224 0.602933
C -2.808103 3.215410 -1.743548
H 3.015083 -0.314723 1.753245
H 1.190595 -1.216589 -0.490000
H 4.365340 0.550806 -0.231299
H 3.253287 -0.241488 -1.338402
H 0.727289 -0.109642 1.967680
H 0.670603 -1.801363 2.475108
H 1.315677 1.122967 -0.289472
H 2.500043 1.965826 0.708208
H 1.248160 -3.748608 0.399814
H -1.001782 -0.552567 0.182404
H -1.074190 -2.257906 0.659730
H 2.693923 1.892145 -2.379549
H 3.623652 2.918281 -1.282468
H 5.712342 -2.817199 1.461990
H 4.776277 -1.889451 2.664338
H 5.702053 -1.035501 1.385104
H -2.005591 -1.710238 2.871577
H -1.600438 0.005696 2.704898
H 1.372328 3.959424 -0.485043
H 1.874543 4.341431 -2.148176
H -6.158047 -1.387425 2.709320
H -5.809669 -0.002977 1.578908
H -1.791012 1.306464 -2.089733
H -2.190783 1.631691 -0.343563
H -5.350478 -1.611816 -0.288245
H -5.571374 -2.995960 0.791043
H -6.959185 -1.986063 0.350404
H -3.848208 2.874613 -1.821340
H -2.513943 3.614374 -2.724938
H -2.782789 4.046527 -1.028462


%chk=000275381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275381

0 1
O -4.272258 -1.271097 2.356448
O -0.676114 2.883643 -1.033514
O -3.643768 0.055686 0.543808
O 0.243681 2.728499 -3.175879
N 3.915209 -2.102116 0.593970
N 3.182683 -3.296467 0.780658
C 3.016924 -0.903347 0.739447
C 1.586945 -1.524266 0.583676
C 3.353120 0.199540 -0.287503
C 0.537526 -0.968681 1.583129
C 2.374673 1.393494 -0.232119
C 1.893853 -3.010228 0.750011
C -0.918006 -1.214341 1.131204
C 2.719959 2.510843 -1.240431
C 5.245826 -2.086190 1.206969
C -1.942753 -0.685010 2.168394
C 1.612673 3.600887 -1.321979
C -3.340240 -0.578691 1.585250
C 0.351810 3.045702 -1.966869
C -5.693624 -1.247674 1.879947
C -1.974304 2.326270 -1.548909
C -5.940152 -2.365191 0.863152
C -2.880733 3.460575 -2.032896
H 3.125788 -0.488158 1.772915
H 1.220431 -1.331046 -0.449117
H 4.387966 0.560846 -0.116859
H 3.335148 -0.253543 -1.297998
H 0.686558 0.123960 1.694419
H 0.714534 -1.415426 2.581858
H 1.347811 1.032268 -0.436143
H 2.354237 1.821140 0.792209
H 1.159326 -3.816840 0.792418
H -1.090617 -0.700095 0.165715
H -1.091642 -2.294240 0.956603
H 2.867811 2.079721 -2.249613
H 3.674131 2.994530 -0.953495
H 5.731943 -3.054911 1.012106
H 5.211309 -1.923450 2.309217
H 5.856221 -1.286748 0.752693
H -1.963121 -1.315689 3.072243
H -1.639246 0.336686 2.473047
H 1.377305 3.990725 -0.316976
H 1.968743 4.435630 -1.952953
H -6.276124 -1.390509 2.803906
H -5.900803 -0.253987 1.445388
H -1.745792 1.621550 -2.367879
H -2.401205 1.785504 -0.690182
H -5.356117 -2.194588 -0.056569
H -5.668189 -3.348316 1.284498
H -7.011610 -2.391295 0.590876
H -3.862980 3.046360 -2.326722
H -2.444125 3.970333 -2.908663
H -3.046925 4.201646 -1.231708


