%chk=000253913.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253913

0 1
O 1.116845 2.288003 3.028436
O 3.526154 1.660984 1.608015
N -1.443039 0.628218 1.601841
N 1.480546 0.567598 1.505527
C -2.296252 1.861354 1.548075
C -2.254469 -0.625039 1.462256
C -0.606302 0.614604 2.837370
C -2.855484 2.033763 0.155632
C -1.331041 -1.755238 1.070972
C 0.737345 1.277346 2.491109
C -1.987365 2.125519 -0.943148
C -0.640101 -1.697248 -0.149664
C -4.240745 2.123190 -0.041674
C -1.156091 -2.857829 1.918525
C -2.503488 2.307301 -2.228133
C 0.228554 -2.729087 -0.511355
C -4.751517 2.308132 -1.330060
C -0.292484 -3.892968 1.546463
C -3.885822 2.399710 -2.423996
C 0.403441 -3.829072 0.335618
C 2.807867 0.861048 1.062851
C 3.209586 0.025761 -0.119462
C 2.470731 0.063296 -1.308883
C 4.362191 -0.764512 -0.023195
C 2.883306 -0.702923 -2.402496
C 4.766588 -1.532370 -1.119143
C 4.027947 -1.502089 -2.306597
H -1.646364 2.741033 1.784852
H -3.106046 1.862562 2.309988
H -3.004357 -0.469141 0.647767
H -2.840647 -0.872793 2.372798
H -1.051152 1.160810 3.699267
H -0.423999 -0.422802 3.198384
H -0.911629 2.051532 -0.784637
H -0.786807 -0.840814 -0.808918
H -4.922509 2.054910 0.803260
H -1.692086 -2.916822 2.863373
H 0.977170 -0.193793 1.018321
H -1.828367 2.381695 -3.079013
H 0.772605 -2.676153 -1.454086
H -5.827425 2.381723 -1.480281
H -0.160761 -4.750690 2.204729
H -4.285803 2.544777 -3.425457
H 1.079369 -4.633333 0.051594
H 1.584479 0.693850 -1.385810
H 4.943277 -0.771371 0.900863
H 2.316650 -0.672247 -3.331854
H 5.661761 -2.149027 -1.048461
H 4.347840 -2.098059 -3.160965


%chk=000253913-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253913

0 1
O 1.522549 1.090936 3.983099
O 3.575115 1.583065 1.875873
N -1.219770 0.323305 1.663176
N 1.446020 0.601208 1.653424
C -1.684728 1.720908 1.378297
C -2.309097 -0.689230 1.482148
C -0.554190 0.234659 2.988001
C -2.089456 1.932442 -0.074325
C -1.769126 -2.105860 1.358753
C 0.917507 0.714516 2.952469
C -1.141362 1.780521 -1.119665
C -1.038389 -2.488137 0.203392
C -3.414191 2.308892 -0.407275
C -1.986953 -3.066408 2.376610
C -1.511560 1.994205 -2.464956
C -0.529919 -3.798286 0.073585
C -3.789151 2.526914 -1.753714
C -1.477792 -4.380718 2.251594
C -2.838276 2.368134 -2.786896
C -0.745414 -4.748729 1.100859
C 2.732537 0.953617 1.183744
C 3.012442 0.544530 -0.242604
C 2.320702 -0.503154 -0.907039
C 4.047163 1.236010 -0.924594
C 2.651960 -0.839395 -2.238422
C 4.370290 0.904580 -2.255789
C 3.670462 -0.132339 -2.918631
H -0.843174 2.392858 1.634435
H -2.533825 1.997101 2.047405
H -2.845637 -0.410865 0.557325
H -3.045281 -0.633000 2.318490
H -1.071732 0.809277 3.786288
H -0.534902 -0.825203 3.304735
H -0.107251 1.504668 -0.881640
H -0.886658 -1.754070 -0.598383
H -4.155431 2.435459 0.391844
H -2.561903 -2.787255 3.268756
H 0.713502 0.269823 0.997077
H -0.765608 1.878753 -3.259317
H 0.026460 -4.084355 -0.826417
H -4.817513 2.818983 -1.994034
H -1.651883 -5.112341 3.048336
H -3.124974 2.537679 -3.830731
H -0.349796 -5.765579 1.001807
H 1.559367 -1.092859 -0.383317
H 4.585848 2.022083 -0.385144
H 2.124456 -1.658089 -2.740473
H 5.166458 1.448283 -2.775700
H 3.924205 -0.394239 -3.951858


