%chk=000264717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264717

0 1
S 4.595270 0.631272 -0.003194
O -2.407577 2.192963 -0.006017
N -0.375552 1.155409 -0.003791
N 1.699230 2.176784 -0.006323
N -2.409194 -0.143684 -0.000721
N 0.414959 -1.234212 0.001437
N 2.850983 -1.410798 0.001504
C 0.583314 0.121631 -0.001587
C 1.873298 0.776051 -0.003249
C 3.006131 -0.061631 -0.001567
C 5.715270 -0.805728 0.000013
C 7.127635 -0.233974 -0.001698
C 0.391549 2.393447 -0.006649
C -1.835552 1.121679 -0.003587
C -3.827947 -0.385073 -0.000153
C 8.164520 -1.356881 0.001241
C 1.582992 -1.937313 0.002795
C -4.232856 -1.736204 0.002773
C -4.776167 0.648726 -0.002342
C -5.594732 -2.036129 0.003480
C -6.134939 0.322705 -0.001582
C -6.548975 -1.012004 0.001315
H 5.523300 -1.445402 -0.883389
H 5.523694 -1.441122 0.886582
H 7.288955 0.412619 -0.890264
H 7.289183 0.417452 0.883290
H -0.128208 3.349303 -0.008725
H -1.805646 -0.986237 0.001107
H 8.068664 -2.001218 -0.880771
H 9.183181 -0.950753 -0.000174
H 8.069108 -1.996178 0.886960
H 1.505438 -3.037783 0.005382
H -3.499619 -2.540273 0.004472
H -4.466359 1.698538 -0.004618
H -5.915848 -3.077967 0.005740
H -6.875719 1.123227 -0.003275
H -7.609284 -1.255444 0.001886


%chk=000264717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264717

0 1
S 4.601874 0.817673 -0.002917
O -2.533758 2.464753 -0.006954
N -0.409080 1.459201 -0.004960
N 1.669195 2.446723 -0.006888
N -2.319400 0.097500 -0.002043
N 0.282544 -0.925301 0.000552
N 2.710706 -1.187337 0.001405
C 0.526595 0.414591 -0.002441
C 1.806757 1.041902 -0.003675
C 2.925974 0.166521 -0.001597
C 5.604437 -0.801690 0.000620
C 7.101966 -0.454207 -0.000624
C 0.344812 2.654995 -0.007393
C -1.870101 1.396341 -0.005091
C -3.676649 -0.337539 -0.000617
C 7.963171 -1.738670 0.001449
C 1.432178 -1.664041 0.002397
C -3.894882 -1.741882 0.002709
C -4.784045 0.551328 -0.002345
C -5.207450 -2.253778 0.004314
C -6.092341 0.020937 -0.000702
C -6.316099 -1.374804 0.002624
H 5.304117 -1.372948 -0.892056
H 5.304604 -1.368773 0.896117
H 7.346407 0.155929 -0.891319
H 7.347131 0.159319 0.887536
H -0.152194 3.621520 -0.009638
H -1.584134 -0.644980 -0.000603
H 7.758740 -2.358166 -0.891299
H 9.038818 -1.487371 0.000548
H 7.759471 -2.354837 0.896668
H 1.318364 -2.750887 0.004688
H -3.037223 -2.425740 0.004025
H -4.613758 1.629556 -0.004901
H -5.363739 -3.338031 0.006882
H -6.944032 0.710246 -0.002040
H -7.336475 -1.772255 0.003872


