%chk=000261303.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261303

0 1
O -4.902775 0.735023 1.121845
N -2.158617 -0.459414 0.195119
N 0.684937 0.013272 -0.142455
N -4.830889 1.220334 -1.079504
C -1.218413 -1.564659 -0.192450
C -1.643878 0.842080 -0.347954
C 0.176642 -1.283778 0.399773
C -0.242787 1.124009 0.232367
C -3.550897 -0.760472 -0.291577
C 2.084213 0.262426 -0.079842
C -4.121874 -1.962927 0.466768
C -4.466960 0.441145 0.027743
C 3.000298 -0.810206 -0.012732
C 2.581549 1.581870 -0.206242
C 4.377677 -0.570127 -0.082054
C 3.954783 1.801898 -0.272935
C 4.861246 0.740777 -0.209964
C 5.327322 -1.724473 -0.016105
H -1.138730 -1.696849 -1.293845
H -1.602247 -2.518764 0.232218
H -2.322594 1.659545 -0.015632
H -1.603025 0.864490 -1.458022
H 0.121173 -1.266988 1.512122
H 0.869141 -2.107366 0.112200
H 0.136541 2.085261 -0.183413
H -0.310046 1.242406 1.338275
H -3.570835 -0.977612 -1.392211
H -3.549383 -2.877932 0.282521
H -4.100746 -1.774497 1.554456
H -5.165141 -2.152750 0.191000
H 2.641491 -1.832386 0.078569
H 1.898099 2.424939 -0.265557
H 4.328257 2.821476 -0.373983
H 5.927739 0.931470 -0.260347
H -4.542779 1.030282 -2.019397
H -5.462315 1.997073 -0.954525
H 5.170906 -2.413841 -0.857872
H 6.378607 -1.410887 -0.047271
H 5.190010 -2.301647 0.908913


%chk=000261303-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261303

0 1
O -4.538673 0.759035 1.475055
N -2.145983 -0.461581 0.104540
N 0.711329 0.018734 -0.152593
N -5.181392 1.164470 -0.716044
C -1.231799 -1.508291 -0.412205
C -1.622560 0.878633 -0.262534
C 0.194826 -1.329555 0.141115
C -0.212681 1.078294 0.313216
C -3.558338 -0.658695 -0.312011
C 2.110765 0.253407 -0.169726
C -4.147287 -1.988941 0.214870
C -4.444486 0.486865 0.245704
C 3.046951 -0.767803 0.168090
C 2.629775 1.523332 -0.572450
C 4.446291 -0.556379 0.092367
C 4.017964 1.738739 -0.634353
C 4.934001 0.709814 -0.309571
C 5.403263 -1.683955 0.447686
H -1.186237 -1.490380 -1.532772
H -1.593521 -2.502147 -0.099199
H -2.285789 1.650909 0.164421
H -1.588002 1.013939 -1.374923
H 0.186057 -1.532248 1.237602
H 0.841172 -2.081318 -0.344100
H 0.162155 2.067610 0.010352
H -0.282548 1.065065 1.424572
H -3.642764 -0.648113 -1.434946
H -3.667849 -2.867526 -0.248791
H -4.015284 -2.033415 1.308727
H -5.227599 -2.042835 -0.009699
H 2.693217 -1.742007 0.521893
H 1.952505 2.331590 -0.865795
H 4.391684 2.719524 -0.951758
H 6.013400 0.890567 -0.364783
H -5.087605 0.962162 -1.709916
H -5.831428 1.889989 -0.412718
H 5.375250 -2.488023 -0.312916
H 6.443933 -1.322274 0.512904
H 5.142988 -2.144989 1.418686


