%chk=000191541.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191541

0 1
O -1.449873 2.425310 1.069594
O 1.463701 2.414917 -1.073789
O -0.190889 0.267050 1.972940
O 0.191302 0.263358 -1.974317
O 1.745292 -2.189060 0.027343
O -1.760297 -2.178194 -0.025752
N 1.912576 0.921258 1.275271
N -1.908077 0.931607 -1.277610
N 3.172290 -0.539260 -1.001482
N -3.176859 -0.518153 1.001013
C -0.062527 2.339698 0.772983
C 0.075859 2.338305 -0.777039
C 0.536159 1.061990 1.393690
C -0.530798 1.063591 -1.396160
C 2.514853 -0.425934 1.372563
C -2.518741 -0.411933 -1.373176
C 2.532534 -1.050638 -0.018005
C -2.540322 -1.034761 0.018181
C 1.277512 -2.725262 -1.236184
C -1.295902 -2.715780 1.238437
H 0.400085 3.266071 1.192548
H -0.380989 3.267020 -1.197740
H 2.427530 1.578146 0.659867
H -2.418912 1.592469 -0.663023
H 1.930732 -1.068022 2.080411
H 3.553556 -0.337555 1.770398
H -1.938643 -1.058557 -2.080210
H -3.556869 -0.317580 -1.771131
H -1.762426 1.607451 1.571821
H 1.771181 1.594485 -1.574947
H 3.133779 -0.947029 -1.929523
H -3.140919 -0.925017 1.929555
H 0.534762 -3.467023 -0.913876
H 2.103508 -3.194306 -1.773307
H 0.785977 -1.932602 -1.820851
H -0.557686 -3.462453 0.917052
H -2.124809 -3.179122 1.776025
H -0.799549 -1.925483 1.822231


%chk=000191541-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191541

0 1
O -1.377722 2.469768 1.244907
O 1.392368 2.455982 -1.252008
O -0.013926 0.479254 2.280971
O 0.014027 0.473281 -2.282891
O 1.609345 -1.997019 -0.042290
O -1.622380 -1.985825 0.044805
N 1.924112 0.867509 1.000224
N -1.920911 0.878205 -1.002710
N 3.820811 -1.148421 -0.657438
N -3.829301 -1.125058 0.659532
C 0.003775 2.397737 0.776416
C 0.010365 2.395655 -0.783359
C 0.656351 1.140768 1.414708
C -0.651516 1.141903 -1.418444
C 2.660500 -0.358422 1.358075
C -2.665467 -0.343717 -1.357425
C 2.780242 -1.235544 0.117324
C -2.789233 -1.218237 -0.115218
C 1.376046 -2.606999 -1.368529
C -1.392271 -2.596313 1.371385
H 0.560447 3.298760 1.101119
H -0.539470 3.299987 -1.110457
H 2.274482 1.450694 0.220729
H -2.266915 1.465365 -0.224267
H 2.098413 -0.874563 2.151908
H 3.672856 -0.103636 1.708309
H -2.107677 -0.864689 -2.151155
H -3.676661 -0.083185 -1.706748
H -1.427389 1.797741 1.995215
H 1.436984 1.781159 -2.000160
H 3.800018 -1.733066 -1.515467
H -3.811369 -1.708987 1.518123
H 0.372186 -3.045851 -1.294763
H 2.129127 -3.388068 -1.586769
H 1.373495 -1.822251 -2.146491
H -0.391100 -3.041223 1.297414
H -2.149975 -3.372673 1.590475
H -1.384565 -1.811019 2.148753


