%chk=000215240.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215240

0 1
O 2.169086 1.952350 0.493294
O -2.792730 2.342216 -1.276295
O -3.614173 1.874732 0.667778
O 6.769317 0.164768 -0.277462
O 5.599243 -1.547976 0.563833
N -2.822799 1.700725 -0.241760
C -3.525428 -1.290982 -0.072149
C -2.098578 -0.724264 0.029632
C -3.499394 -2.801057 -0.385934
C -4.319316 -0.599527 -1.194603
C -4.198342 -1.070136 1.292400
C -1.787275 0.646346 -0.070370
C -1.014991 -1.594524 0.262228
C 0.588136 0.223665 0.192809
C -0.467632 1.118869 -0.005188
C 0.299040 -1.141003 0.342466
C 1.975904 0.779209 0.258965
C 3.111555 -0.190020 0.005717
C 4.454748 0.530181 -0.085226
C 5.591027 -0.423105 0.121335
H -2.985110 -3.380744 0.388792
H -4.519367 -3.201151 -0.446650
H -3.014855 -3.006465 -1.346910
H -5.124316 -1.245491 -1.568863
H -4.823949 0.314777 -0.858066
H -3.693576 -0.350119 -2.058432
H -5.229403 -1.441158 1.289537
H -3.666165 -1.582301 2.100326
H -4.246123 -0.002480 1.559520
H -1.203328 -2.664548 0.391144
H -0.252322 2.192430 -0.103791
H 1.100381 -1.859762 0.528900
H 3.144749 -0.949525 0.823186
H 2.922474 -0.771523 -0.921663
H 4.562543 1.065137 -1.056065
H 4.511582 1.352017 0.674196
H 7.559789 -0.424662 -0.142131


%chk=000215240-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215240

0 1
O 2.208328 2.046709 -0.043050
O -2.702156 2.633887 -1.075663
O -3.669954 1.854366 0.832709
O 6.916174 0.129739 -0.091376
O 5.589442 -1.397026 1.045636
N -2.799986 1.779084 -0.116702
C -3.575657 -1.299861 -0.038291
C -2.139123 -0.708013 0.000606
C -3.548230 -2.808039 -0.428574
C -4.472204 -0.581481 -1.093521
C -4.218591 -1.195171 1.382686
C -1.793787 0.678878 -0.075873
C -1.018452 -1.582164 0.085085
C 0.614501 0.245495 -0.015837
C -0.468326 1.148340 -0.110965
C 0.316610 -1.135790 0.090837
C 2.013170 0.796434 -0.026692
C 3.181778 -0.188813 0.005241
C 4.541959 0.508728 -0.140290
C 5.679841 -0.367034 0.339200
H -3.070034 -3.438100 0.342881
H -4.589137 -3.163063 -0.528426
H -3.037907 -2.977985 -1.394509
H -5.422448 -1.136920 -1.190557
H -4.735377 0.448600 -0.810940
H -3.988569 -0.566075 -2.087391
H -5.222867 -1.657951 1.362475
H -3.608172 -1.735916 2.129406
H -4.318391 -0.147225 1.702990
H -1.197836 -2.657490 0.137101
H -0.258728 2.218944 -0.200740
H 1.120632 -1.874264 0.171512
H 3.156674 -0.750199 0.961654
H 3.046018 -0.951287 -0.785810
H 4.737926 0.823083 -1.179840
H 4.547710 1.446436 0.449195
H 7.645569 -0.443956 0.270335


