%chk=000200449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200449

0 1
O -3.799538 0.349568 1.268907
N 3.113417 0.913722 -0.336210
C 0.869070 -0.038190 0.083388
C 1.204836 0.950030 1.236930
C 1.895307 0.374163 -1.016328
C 2.636213 1.490451 0.975062
C 1.112992 -1.496616 0.545999
C -0.581238 0.094704 -0.357785
C 2.661891 3.017511 0.855681
C 0.842665 -2.539737 -0.545765
C 4.155240 -0.136203 -0.139205
C -1.586190 0.172256 0.610628
C -0.939530 0.101064 -1.720252
C 1.185580 -3.950348 -0.072903
C -2.929432 0.276237 0.201497
C -2.277250 0.205525 -2.100971
C -3.297523 0.297635 -1.148436
C -5.214055 0.459560 0.982677
H 1.138433 0.468304 2.223245
H 0.475403 1.779799 1.257674
H 2.133807 -0.458426 -1.702072
H 1.491988 1.206581 -1.634213
H 3.310761 1.186799 1.811701
H 0.477813 -1.713238 1.426560
H 2.163192 -1.588498 0.896376
H 2.010129 3.368263 0.045974
H 2.342945 3.497843 1.784357
H 3.672568 3.370013 0.614202
H 1.427774 -2.295382 -1.455186
H -0.222545 -2.496051 -0.851948
H 3.815933 -1.018671 0.430030
H 5.020620 0.308251 0.376365
H 4.507379 -0.475383 -1.126419
H -1.361895 0.150135 1.674225
H -0.176516 0.020808 -2.489669
H 2.243420 -4.043104 0.196198
H 0.596704 -4.234550 0.806926
H 0.979756 -4.689473 -0.855425
H -2.536608 0.214532 -3.160156
H -4.330758 0.380439 -1.460426
H -5.645373 0.498093 1.991358
H -5.562071 -0.424513 0.441045
H -5.419814 1.382396 0.432965


%chk=000200449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200449

0 1
O -3.849859 0.759896 1.142868
N 2.693555 1.251280 -0.506822
C 0.858677 -0.241968 0.110227
C 1.220862 0.781577 1.250287
C 1.981153 0.028426 -0.956619
C 2.680780 1.203340 0.980321
C 0.993116 -1.700499 0.681451
C -0.583633 -0.049537 -0.400710
C 3.065843 2.541161 1.629891
C 0.795642 -2.852339 -0.329624
C 4.009436 1.427610 -1.137705
C -1.601223 0.288456 0.521965
C -0.962598 -0.282715 -1.752309
C 0.983575 -4.237184 0.327953
C -2.951180 0.412805 0.116862
C -2.308064 -0.154844 -2.154402
C -3.320591 0.195316 -1.232387
C -5.259743 0.911700 0.781290
H 1.095238 0.345596 2.258372
H 0.583407 1.680467 1.175093
H 2.678541 -0.848390 -0.987378
H 1.596901 0.180200 -1.979692
H 3.377468 0.403937 1.355808
H 0.254023 -1.820209 1.500188
H 1.998463 -1.794224 1.143783
H 2.432918 3.349939 1.222176
H 2.917853 2.494944 2.724401
H 4.124529 2.801771 1.448208
H 1.513380 -2.745588 -1.168134
H -0.216360 -2.785217 -0.771687
H 4.723657 0.595186 -0.903832
H 4.466406 2.377310 -0.810430
H 3.891401 1.473631 -2.235441
H -1.372436 0.468894 1.577093
H -0.212494 -0.565966 -2.496929
H 2.002771 -4.346957 0.745251
H 0.265328 -4.381666 1.157207
H 0.826516 -5.054151 -0.400263
H -2.578256 -0.331952 -3.201920
H -4.357524 0.291080 -1.567543
H -5.769803 1.180926 1.718099
H -5.680832 -0.033952 0.386517
H -5.401347 1.718207 0.035120


