%chk=000290351.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290351

0 1
S -1.741913 2.166106 -0.029937
O -0.024416 4.396756 1.485632
N 0.761369 1.225080 -0.032159
N -0.955777 -0.415406 0.331655
C 1.163470 2.418827 0.773131
C 0.448106 3.718458 0.320628
C -0.689864 3.491809 -0.665643
C 1.819319 0.223404 -0.136565
C -0.576572 0.795021 0.136010
C 1.986618 -0.814763 0.792848
C 2.689064 0.350304 -1.231682
C 3.912635 -1.604254 -0.464193
C 3.030357 -1.724071 0.622886
C 3.732859 -0.562354 -1.388164
C -2.292150 -0.901557 0.260197
C 5.021444 -2.590413 -0.635498
C -2.972161 -0.978841 -0.970326
C -2.874363 -1.415397 1.434913
C -4.234330 -1.572807 -1.014680
C -4.138536 -2.002535 1.367518
C -4.820957 -2.082288 0.148693
H 2.264484 2.553066 0.665053
H 0.986262 2.265399 1.863325
H 1.188269 4.451902 -0.084551
H -1.315870 4.401437 -0.771911
H -0.307686 3.237875 -1.674207
H 1.291602 -0.926927 1.626148
H 2.542873 1.150227 -1.956421
H -0.788795 3.929278 1.893129
H 3.155964 -2.536606 1.336907
H 4.406013 -0.466472 -2.238192
H 5.571534 -2.752487 0.301909
H 5.756034 -2.278154 -1.388897
H 4.628619 -3.567933 -0.954293
H -2.513783 -0.586513 -1.875520
H -2.337395 -1.359231 2.379095
H -4.765293 -1.637934 -1.963683
H -4.595565 -2.401695 2.272183
H -5.805669 -2.541208 0.105563


%chk=000290351-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290351

0 1
S -1.806247 2.224496 0.168266
O 0.460179 4.871533 0.476150
N 0.705831 1.108388 0.511420
N -1.083779 -0.452156 0.783671
C 1.024614 2.507952 0.901916
C 0.659995 3.571990 -0.174891
C -0.574614 3.115178 -0.970163
C 1.785195 0.209644 0.175420
C -0.646411 0.741069 0.537194
C 1.710384 -1.191843 0.393964
C 2.969584 0.742949 -0.403230
C 3.983604 -1.501535 -0.532819
C 2.793511 -2.020624 0.036917
C 4.047210 -0.101461 -0.741131
C -2.393495 -0.953018 0.586278
C 5.134994 -2.413708 -0.918307
C -3.065232 -0.859588 -0.665267
C -3.011942 -1.659230 1.653896
C -4.337259 -1.446181 -0.830832
C -4.289847 -2.231468 1.482007
C -4.960888 -2.128732 0.240345
H 2.087860 2.569501 1.173131
H 0.437644 2.748466 1.807810
H 1.497917 3.754378 -0.870396
H -1.104921 3.979001 -1.401712
H -0.303957 2.408021 -1.769791
H 0.805926 -1.611049 0.836995
H 3.053536 1.814433 -0.613919
H -0.332341 4.798875 1.072553
H 2.710673 -3.099478 0.218800
H 4.947860 0.338799 -1.185795
H 5.382963 -3.118025 -0.103123
H 6.045766 -1.837829 -1.157053
H 4.883166 -3.022954 -1.807744
H -2.583141 -0.337209 -1.497857
H -2.477506 -1.746483 2.605518
H -4.842286 -1.371553 -1.800767
H -4.758971 -2.764833 2.316589
H -5.949774 -2.580613 0.106855


