%chk=000281992.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281992

0 1
O -1.131731 2.636599 1.056871
O -3.339631 -1.909137 0.572560
O -1.484490 1.176572 -0.641846
O -1.841640 -3.072686 -0.712419
O 4.278005 1.436824 0.148965
N -1.125655 -1.862269 1.160552
N 1.792000 0.278182 0.452265
N 2.804265 -0.371093 -0.197224
N 4.991492 -0.348674 -1.116032
C -0.410511 0.453746 1.459235
C -1.419793 -0.617741 1.937563
C 0.282822 -1.787826 0.658972
C 0.702237 -0.336452 0.789110
C -1.057788 1.404763 0.462832
C -2.077738 -2.320214 0.209139
C -1.641657 3.760413 0.264947
C -4.445490 -2.349289 -0.288202
C -0.573445 4.224295 -0.700770
C -4.438230 -1.553635 -1.574181
C 4.034371 0.362930 -0.348452
H -0.007420 1.044698 2.324684
H -2.479317 -0.299799 1.823169
H -1.259700 -0.852993 3.013805
H 0.904649 -2.447733 1.307673
H 0.363211 -2.166811 -0.387115
H -2.569036 3.439954 -0.240738
H -1.857225 4.491931 1.065221
H 2.777590 -1.380263 -0.373666
H -5.304969 -2.121221 0.368648
H -4.348126 -3.436895 -0.453128
H -0.838721 5.177970 -1.170701
H 0.394620 4.356802 -0.195814
H -0.412092 3.489908 -1.504344
H -3.594281 -1.845281 -2.219630
H -4.327388 -0.476611 -1.384054
H -5.359828 -1.701425 -2.147856
H 4.705822 -1.004092 -1.826840
H 5.823018 0.179152 -1.365401


%chk=000281992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281992

0 1
O -1.018404 3.019855 1.015686
O -3.360498 -2.152190 0.580003
O -1.131692 1.692478 -0.904861
O -1.874267 -3.109655 -0.992136
O 4.729187 0.844820 0.857502
N -1.223209 -1.356342 0.405149
N 1.976857 0.312460 0.635063
N 2.937127 -0.421922 -0.035030
N 5.137401 -0.826827 -0.719290
C -0.375763 0.716734 1.244317
C -1.487169 -0.352888 1.461999
C 0.138686 -1.289926 -0.148190
C 0.732977 -0.078857 0.560451
C -0.870334 1.828799 0.313409
C -2.124239 -2.269478 -0.083384
C -1.468448 4.213782 0.225192
C -4.435621 -3.055108 0.076037
C -0.271056 4.896545 -0.440062
C -5.144505 -2.443699 -1.135612
C 4.305204 -0.056395 0.094865
H -0.034294 1.168827 2.186542
H -2.510041 0.042714 1.364409
H -1.386178 -0.800984 2.469274
H 0.703062 -2.224353 0.061504
H 0.101795 -1.159018 -1.249016
H -2.210527 3.878828 -0.520835
H -1.947300 4.854526 0.982353
H 2.679315 -1.232100 -0.613886
H -5.109816 -3.160488 0.941541
H -3.984631 -4.030949 -0.176323
H -0.604542 5.822619 -0.944106
H 0.494579 5.164748 0.307584
H 0.185722 4.237315 -1.196705
H -4.449251 -2.354784 -1.987118
H -5.546954 -1.444287 -0.895301
H -5.986812 -3.091521 -1.443121
H 4.807536 -1.494157 -1.413788
H 6.134303 -0.636520 -0.656320


