%chk=000265607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265607

0 1
O -2.099252 -2.037447 -1.346610
O -3.820332 2.031644 0.006133
N 0.416314 -1.331348 0.324723
N -1.716596 1.509713 0.778725
N 0.544640 0.658503 1.451693
N -2.962406 -0.009991 -0.669966
C 2.553039 -0.872617 1.642859
C 1.195574 -0.520805 1.144258
C -0.789050 -0.644404 0.086447
C 3.593778 -0.972018 0.517420
C -0.677381 0.581703 0.800193
C 3.831709 0.378703 -0.168451
C -1.936683 -1.018135 -0.701640
C 4.882751 0.267497 -1.280967
C 0.735001 -2.653528 -0.216904
C -2.903602 1.231961 0.033222
C -1.596008 2.783750 1.527773
C 5.118405 1.611883 -1.965203
C -4.216864 -0.252181 -1.435227
H 2.873016 -0.099584 2.383292
H 2.511688 -1.825990 2.212038
H 3.274852 -1.726470 -0.231268
H 4.545081 -1.350885 0.942025
H 2.879862 0.766973 -0.583404
H 4.149492 1.132495 0.578495
H 4.561618 -0.480542 -2.032025
H 5.836842 -0.110598 -0.864188
H 1.735503 -2.650469 -0.691986
H 0.718079 -3.420911 0.578215
H -0.017403 -2.950772 -0.983924
H -2.509808 3.393462 1.392417
H -0.723980 3.357342 1.166084
H -1.455462 2.581024 2.604539
H 5.474570 2.369473 -1.257498
H 5.868410 1.526912 -2.759582
H 4.200048 1.999638 -2.421784
H -4.164879 -1.234059 -1.942538
H -4.362437 0.535936 -2.194066
H -5.087827 -0.244555 -0.757318


%chk=000265607-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265607

0 1
O -2.419850 -2.281442 -1.070883
O -3.718782 2.160887 -0.161247
N 0.271923 -1.534877 0.348212
N -1.579254 1.503193 0.546668
N 0.617088 0.560716 1.192180
N -3.042266 -0.041655 -0.597140
C 2.527660 -1.094928 1.452021
C 1.152956 -0.685611 1.014032
C -0.892992 -0.791952 0.086564
C 3.608459 -0.981224 0.333014
C -0.641229 0.483499 0.616585
C 3.883860 0.471352 -0.113937
C -2.123723 -1.150112 -0.566210
C 4.951477 0.560210 -1.228170
C 0.474090 -2.956857 0.015245
C -2.829130 1.266691 -0.071997
C -1.284399 2.831459 1.117066
C 5.238477 2.012723 -1.666248
C -4.360008 -0.256910 -1.238213
H 2.812679 -0.440248 2.294408
H 2.503411 -2.134575 1.832553
H 3.306898 -1.587120 -0.546034
H 4.546041 -1.431387 0.716757
H 2.943233 0.940365 -0.463251
H 4.214295 1.065886 0.762670
H 4.614597 -0.031006 -2.104544
H 5.891124 0.086598 -0.876460
H 1.377049 -3.084430 -0.605117
H 0.579068 -3.558714 0.935232
H -0.408583 -3.304124 -0.543876
H -2.160784 3.471269 0.939076
H -0.391640 3.261117 0.632638
H -1.088930 2.743823 2.198988
H 5.606923 2.617257 -0.816172
H 6.001547 2.051752 -2.465103
H 4.321846 2.499249 -2.049554
H -4.387777 -1.299740 -1.586111
H -4.486952 0.437702 -2.084615
H -5.168098 -0.067532 -0.513026


