%chk=000259600.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259600

0 1
O -4.522331 0.398709 0.474046
O -4.973300 -0.527158 -1.509419
O -2.204169 3.044123 -1.046655
O 1.983494 1.586139 1.843271
O -0.067292 0.562363 2.031331
N -2.021325 1.011030 -0.011477
N 0.152419 2.785935 1.343685
C -1.593640 -1.957766 -0.241073
C -1.963715 -1.047403 -1.433452
C -2.681012 0.271934 -1.096731
C -0.928126 -3.232660 -0.778917
C -2.805566 -2.320432 0.619779
C -4.155116 -0.013895 -0.784452
C -1.877110 2.391195 -0.071840
C -1.287985 3.038852 1.195825
C 0.607435 1.540583 1.752261
C 2.655005 0.319158 2.155894
C 2.961524 -0.397250 0.873062
C 1.954129 -1.118572 0.216076
C 4.252412 -0.344404 0.327682
C 2.242695 -1.788119 -0.975124
C 4.535162 -1.019106 -0.863490
C 3.531192 -1.742240 -1.515861
H -0.844398 -1.418022 0.403043
H -2.598239 -1.614794 -2.149531
H -1.034769 -0.800146 -1.989298
H -2.692740 0.929746 -2.025621
H -0.620802 -3.892536 0.040693
H -0.026954 -3.005356 -1.368461
H -1.607198 -3.808476 -1.417559
H -3.196988 -1.453999 1.167221
H -2.544837 -3.073725 1.372796
H -3.623636 -2.736084 0.019871
H -1.743667 0.473860 0.823578
H -1.459285 4.141697 1.131202
H -1.841352 2.681461 2.099550
H -5.488853 0.239195 0.655615
H 0.802551 3.482955 0.986415
H 3.551572 0.687696 2.689836
H 2.018704 -0.275513 2.840249
H 0.938976 -1.150256 0.632981
H 5.035860 0.224167 0.826447
H 1.451234 -2.352551 -1.480758
H 5.538416 -0.978592 -1.284901
H 3.752924 -2.266743 -2.443888


%chk=000259600-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259600

0 1
O -4.682615 0.591527 0.838505
O -5.259969 -0.660598 -1.025463
O -2.702292 3.171886 -0.913532
O 2.019076 1.657181 1.667848
O -0.088771 0.631464 1.984870
N -2.178281 1.088823 0.007904
N 0.133365 2.794995 1.114560
C -1.687081 -1.910186 -0.464466
C -2.304068 -0.930394 -1.499777
C -3.002210 0.339763 -0.937718
C -1.010062 -3.076569 -1.225010
C -2.715238 -2.457019 0.555612
C -4.410106 0.016471 -0.406971
C -2.118845 2.465306 -0.035019
C -1.305264 3.107306 1.113420
C 0.623262 1.613502 1.611009
C 2.709881 0.394900 2.113217
C 3.137931 -0.448647 0.933730
C 2.341146 -1.539893 0.504062
C 4.345319 -0.161947 0.246361
C 2.743592 -2.330076 -0.596030
C 4.747497 -0.947997 -0.855397
C 3.946995 -2.035677 -1.277537
H -0.894722 -1.372695 0.097969
H -3.050244 -1.469779 -2.114669
H -1.500260 -0.589840 -2.180288
H -3.191942 1.026724 -1.788889
H -0.507592 -3.768317 -0.522783
H -0.254535 -2.704991 -1.942459
H -1.759994 -3.660445 -1.792435
H -3.128387 -1.661950 1.203091
H -2.238033 -3.201591 1.219320
H -3.559970 -2.950581 0.039352
H -1.685707 0.607291 0.774930
H -1.424992 4.197047 1.016280
H -1.740545 2.785248 2.078085
H -5.624357 0.380730 1.085632
H 0.803548 3.479160 0.762844
H 3.572468 0.781409 2.678871
H 2.021132 -0.148844 2.781532
H 1.407492 -1.763325 1.033437
H 4.967756 0.679172 0.575556
H 2.123990 -3.174130 -0.917414
H 5.682174 -0.719417 -1.379286
H 4.260753 -2.649996 -2.128949


