%chk=000263351.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263351

0 1
O -2.570282 -3.248084 1.446891
N -0.971972 -2.880365 -2.942124
C 0.072134 -0.645011 -0.492360
C 0.175575 -2.184518 -0.691362
C -1.311575 -0.205147 -0.060306
C -0.424116 -2.956452 0.485259
C 1.148440 -0.193117 0.476773
C -2.185780 -1.089347 0.544577
C -1.719065 1.155131 -0.295342
C -1.816535 -2.495577 0.867883
C 2.457929 0.134925 -0.027026
C -3.036749 1.551433 0.059610
C -3.508380 -0.676780 0.897782
C 0.893919 -0.113356 1.827243
C -3.926436 0.603498 0.657715
C -0.474706 -2.571387 -1.947267
C 3.466702 0.527274 0.892196
C -0.845208 2.135436 -0.869161
C 2.788664 0.084185 -1.419620
C 1.909115 0.287457 2.741235
C -3.459074 2.898502 -0.181297
C 3.165522 0.597784 2.289669
C -1.271341 3.421268 -1.085535
C 4.776023 0.848970 0.408878
C -2.599028 3.808403 -0.740840
C 4.050227 0.397507 -1.858468
C 5.061021 0.783827 -0.931123
H 0.272864 -0.170362 -1.498472
H 1.268746 -2.455416 -0.775852
H 0.232511 -2.853000 1.378829
H -0.444833 -4.048697 0.275663
H -4.167614 -1.418657 1.361602
H -0.094555 -0.346193 2.227532
H -4.935602 0.921131 0.917458
H 0.176625 1.849963 -1.124981
H 2.015979 -0.203966 -2.134469
H 1.663738 0.341835 3.801786
H -4.475500 3.181829 0.089858
H 3.950619 0.903260 2.980293
H -0.604528 4.164807 -1.520131
H 5.538232 1.146192 1.128646
H -2.912282 4.835169 -0.928420
H 4.299132 0.357440 -2.918526
H 6.054445 1.025508 -1.306800


%chk=000263351-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000263351

0 1
O -2.520246 -3.346431 1.384594
N -1.017531 -2.769198 -3.069389
C 0.075271 -0.547515 -0.523368
C 0.195924 -2.095296 -0.786806
C -1.338769 -0.168223 -0.080373
C -0.337099 -2.906392 0.420128
C 1.177536 -0.094506 0.450897
C -2.200051 -1.115013 0.517418
C -1.807467 1.185195 -0.278187
C -1.760954 -2.514932 0.806231
C 2.533152 0.088315 -0.028256
C -3.163529 1.531886 0.104040
C -3.539556 -0.756148 0.895330
C 0.895785 0.119827 1.805870
C -4.011459 0.530540 0.688210
C -0.489808 -2.470609 -2.041721
C 3.563391 0.486837 0.914745
C -0.980015 2.217025 -0.839975
C 2.916180 -0.099264 -1.401709
C 1.913001 0.508975 2.729934
C -3.636903 2.867187 -0.103697
C 3.224149 0.688126 2.293263
C -1.466742 3.512794 -1.027598
C 4.908437 0.676512 0.454326
C -2.808373 3.843143 -0.661453
C 4.234832 0.095104 -1.821102
C 5.243967 0.484819 -0.886546
H 0.255161 -0.054981 -1.497087
H 1.267934 -2.335121 -0.923764
H 0.322422 -2.709567 1.288560
H -0.312421 -3.992381 0.230074
H -4.159929 -1.535622 1.348236
H -0.131631 0.002712 2.166759
H -5.034896 0.802626 0.970986
H 0.056821 1.998274 -1.112157
H 2.169219 -0.393734 -2.146604
H 1.651775 0.667800 3.781459
H -4.665820 3.110890 0.185694
H 4.011370 0.987966 2.994935
H -0.816648 4.283473 -1.455254
H 5.673108 0.978360 1.179922
H -3.179710 4.861843 -0.816767
H 4.499050 -0.050564 -2.874106
H 6.274072 0.632570 -1.227795


