%chk=000219980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219980

0 1
O 0.369958 -1.412415 0.183250
O 2.630814 -2.931421 -0.595570
O 0.675637 0.675848 1.705789
O 4.631185 -1.484688 -1.882212
O 2.057502 2.659528 -0.302622
O -0.560115 2.723098 -0.566557
N -0.763505 0.577945 -1.384218
N -2.152788 0.655037 -1.631377
C 1.712597 -0.989648 0.499065
C 2.551479 -1.500666 -0.686459
C 1.718575 0.537751 0.726203
C 4.032774 -1.028383 -0.669908
C 1.432581 1.399046 -0.526525
C 4.800270 -1.536744 0.540984
C -0.068094 1.623815 -0.780961
C -2.996545 0.290951 -0.500531
C -4.053995 1.135399 -0.118828
C -2.823689 -0.959122 0.118523
C -4.940987 0.716780 0.874996
C -3.714403 -1.357119 1.117594
C -4.771952 -0.524420 1.497796
H 2.013020 -1.506642 1.444155
H 2.072020 -1.244040 -1.660150
H 2.681712 0.882859 1.177420
H 4.098789 0.081166 -0.773747
H 1.945276 0.993009 -1.433418
H 4.593599 -2.601352 0.730174
H 5.882816 -1.442659 0.374361
H 4.558516 -0.984840 1.453646
H -0.238894 -1.119297 0.920926
H 1.720706 -3.313298 -0.618093
H 0.544171 1.621938 1.945186
H 4.620570 -2.471877 -1.917403
H 1.372269 3.379245 -0.169815
H -0.405749 -0.397332 -1.336454
H -2.383025 1.606953 -1.987077
H -4.184224 2.109130 -0.588434
H -2.020978 -1.626159 -0.195295
H -5.765613 1.365726 1.170108
H -3.587247 -2.326794 1.598635
H -5.463431 -0.842205 2.275743


%chk=000219980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219980

0 1
O 0.582883 -1.781164 0.194965
O 2.692822 -2.818800 -1.252709
O 0.904813 0.167393 2.086016
O 4.672927 -1.223199 -2.290897
O 1.746382 2.604088 0.800787
O -0.514413 2.728340 -0.524552
N -0.679678 0.425866 -0.885685
N -2.002762 0.476051 -1.360549
C 1.936170 -1.199276 0.418922
C 2.667229 -1.385093 -0.919094
C 1.841141 0.242371 0.955331
C 4.151009 -0.939693 -0.945909
C 1.452702 1.404714 0.009567
C 5.021624 -1.602819 0.138012
C -0.023176 1.553142 -0.467578
C -3.076883 0.314870 -0.440181
C -4.407031 0.434245 -0.927445
C -2.855628 -0.016873 0.922704
C -5.496470 0.227456 -0.058659
C -3.959254 -0.230924 1.777836
C -5.283684 -0.113462 1.299234
H 2.432508 -1.809593 1.197415
H 2.125397 -0.837186 -1.720585
H 2.851722 0.520980 1.322229
H 4.208698 0.160639 -0.860921
H 2.096867 1.383327 -0.896026
H 4.907152 -2.700333 0.111104
H 6.078402 -1.350766 -0.051414
H 4.764807 -1.246414 1.154059
H 0.115153 -1.792594 1.070816
H 1.766190 -3.164265 -1.180147
H 0.851205 1.078253 2.477866
H 4.436981 -2.167888 -2.492646
H 1.082623 3.294452 0.497004
H -0.285352 -0.518531 -0.692008
H -2.135968 1.140620 -2.127271
H -4.581086 0.680534 -1.981984
H -1.835114 -0.071478 1.317772
H -6.516988 0.326825 -0.445597
H -3.778775 -0.480809 2.829867
H -6.133544 -0.278902 1.969249


