%chk=000235229.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235229

0 1
O -0.715392 1.739704 2.080652
O -3.210618 -2.767165 1.074013
O -4.981958 -1.949327 -0.278929
O 2.843393 -0.516793 -2.402257
O 3.208723 -1.057120 2.384928
O 4.185192 -1.630471 -0.301292
N -0.520750 2.712260 -0.114874
C -0.559230 1.446661 0.671681
C -1.787083 0.593511 0.367607
C -1.859930 3.378674 -0.164529
C -2.798525 2.472813 -0.975269
C -2.844571 1.083066 -0.407935
C 0.732857 0.659384 0.412343
C -1.821121 -0.709115 0.933734
C -3.984044 0.283749 -0.696301
C 0.544625 3.653039 0.333569
C -2.930492 -1.468711 0.654223
C -3.998205 -0.979413 -0.155974
C 1.449974 0.125230 1.477986
C 1.158245 0.467855 -0.909265
C 2.319174 -0.270633 -1.155113
C 2.631838 -0.606685 1.229007
C -4.513289 -3.102345 0.500152
C 3.084663 -0.813795 -0.088978
C 2.098365 -0.035851 -3.550682
C 4.398018 -1.885410 2.292439
C 5.265430 -1.000996 -1.043950
H -1.756047 4.364445 -0.663388
H -2.279622 3.560285 0.850716
H -2.448939 2.416843 -2.030382
H -3.810301 2.923440 -1.008816
H -1.009027 -1.074819 1.562156
H -4.800163 0.657683 -1.305914
H 1.516679 3.131117 0.353177
H 0.366257 4.108766 1.319040
H 0.632959 4.462127 -0.410739
H 0.096596 2.114677 2.471668
H 1.111942 0.233168 2.508855
H 0.574285 0.900469 -1.719572
H -5.219122 -3.256114 1.326776
H -4.372515 -3.939904 -0.195215
H 2.039611 1.056102 -3.535601
H 1.106180 -0.496991 -3.578157
H 2.720189 -0.391557 -4.381716
H 5.230344 -1.293815 1.902630
H 4.206169 -2.755265 1.652518
H 4.550030 -2.172489 3.338766
H 5.604097 -0.098347 -0.532900
H 4.932402 -0.781417 -2.066102
H 6.029708 -1.784621 -1.038387


%chk=000235229-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235229

0 1
O -0.650010 1.821657 2.120473
O -3.071467 -2.822669 1.295908
O -4.876119 -2.161745 -0.140057
O 3.009277 -0.255254 -2.482924
O 3.384739 -1.093721 2.308531
O 4.401834 -1.403159 -0.348969
N -0.563785 2.715534 -0.184862
C -0.526981 1.502644 0.646176
C -1.743305 0.592463 0.379332
C -1.911043 3.320509 -0.320921
C -2.811759 2.362818 -1.109835
C -2.817735 0.989425 -0.459711
C 0.800663 0.749017 0.396326
C -1.758282 -0.679905 1.023407
C -3.921683 0.114264 -0.686276
C 0.481208 3.712128 0.133468
C -2.850666 -1.508383 0.796252
C -3.912402 -1.123781 -0.049497
C 1.505030 0.128956 1.447513
C 1.282571 0.632128 -0.930105
C 2.469936 -0.080809 -1.195897
C 2.706168 -0.575682 1.190203
C -4.458361 -3.155785 0.886590
C 3.217500 -0.673528 -0.131352
C 2.230008 0.261213 -3.612005
C 3.710324 -2.537633 2.287271
C 5.523296 -0.659945 -0.964641
H -1.798587 4.275602 -0.865711
H -2.358539 3.545484 0.674421
H -2.431447 2.291560 -2.148857
H -3.841357 2.764348 -1.162892
H -0.939915 -0.987265 1.676262
H -4.752943 0.415908 -1.329922
H 1.467656 3.221661 0.191763
H 0.294905 4.255134 1.089628
H 0.524230 4.462408 -0.675675
H 0.207699 2.231531 2.411416
H 1.144312 0.168745 2.479172
H 0.711590 1.117565 -1.726086
H -5.127851 -3.066227 1.763726
H -4.469283 -4.159932 0.436003
H 2.132667 1.363205 -3.565156
H 1.223856 -0.198111 -3.643700
H 2.800242 -0.025073 -4.508061
H 4.349856 -2.783079 1.423960
H 2.778830 -3.135569 2.254692
H 4.240294 -2.723557 3.233970
H 5.797012 0.209381 -0.336928
H 5.256998 -0.331440 -1.982987
H 6.357820 -1.377131 -0.997034


