%chk=000257702.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257702

0 1
N 1.451314 -1.665606 -0.007208
N -4.196363 1.537392 -0.122903
C 0.232400 -0.950909 0.025518
C -2.118599 -0.489180 0.063391
C 0.526487 0.456521 0.039215
C -1.089167 -1.441161 0.046311
C -1.828789 0.902794 0.083370
C -3.560691 -0.918645 0.112524
C 1.971683 0.594213 0.014365
C -0.517154 1.378899 0.072033
C 2.517293 -0.735936 -0.014928
C -4.543779 0.140907 -0.423100
C -1.364896 -2.908956 0.050236
C -2.964479 1.851397 0.099164
C 2.836498 1.689668 0.013426
C 3.897971 -0.968836 -0.044744
C 4.211581 1.457106 -0.016057
C 4.730794 0.148263 -0.044663
H -3.713176 -1.860451 -0.451389
H -3.810569 -1.155790 1.170491
H -0.304993 2.446470 0.085558
H 1.543182 -2.661928 -0.028576
H -4.648531 0.046675 -1.529778
H -5.558199 -0.037328 0.002542
H -0.461644 -3.519140 0.161395
H -2.032353 -3.187394 0.879640
H -1.850360 -3.221910 -0.886680
H -2.727288 2.904233 0.312435
H 2.439889 2.702437 0.035205
H 4.302186 -1.974641 -0.066868
H 4.900287 2.299514 -0.017210
H 5.811663 0.008920 -0.067316


%chk=000257702-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257702

0 1
N 1.448371 -1.643288 -0.032329
N -4.257690 1.555581 -0.117543
C 0.230600 -0.943947 0.016938
C -2.140883 -0.508872 0.084451
C 0.526700 0.464560 0.044800
C -1.092303 -1.458452 0.048399
C -1.864683 0.902251 0.105924
C -3.608509 -0.907900 0.185726
C 1.979300 0.599237 0.013697
C -0.536503 1.386728 0.097673
C 2.520491 -0.731696 -0.034833
C -4.531504 0.135613 -0.490171
C -1.362817 -2.954199 0.051412
C -3.003381 1.844280 0.140252
C 2.861256 1.704743 0.020635
C 3.908578 -0.976031 -0.076306
C 4.252483 1.470515 -0.020232
C 4.768044 0.144744 -0.068139
H -3.792506 -1.902831 -0.258732
H -3.881773 -0.985229 1.260568
H -0.349581 2.466773 0.122867
H 1.545053 -2.654769 -0.068380
H -4.433945 0.065933 -1.595292
H -5.588104 -0.075025 -0.248009
H -0.441123 -3.547835 0.181100
H -2.045822 -3.239430 0.871684
H -1.834048 -3.284261 -0.894144
H -2.779928 2.897596 0.374336
H 2.473484 2.728816 0.056538
H 4.313170 -1.993373 -0.112937
H 4.947405 2.317040 -0.015367
H 5.852368 -0.009671 -0.099186


