%chk=000241410.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241410

0 1
S -1.317281 -0.335801 0.373299
F -6.278209 -1.163168 -2.091384
N 3.651710 -0.568778 0.712565
N 1.633619 -1.677117 0.812460
N 2.800059 1.718110 0.159205
N 0.317507 1.753336 0.011471
N 1.624044 3.678584 -0.442923
C 5.751459 -0.720619 -0.694375
C 5.108367 -0.361765 0.671352
C 2.671941 0.379913 0.426500
C 5.133284 0.094054 -1.830685
C 5.669096 -2.221646 -0.980516
C 1.405728 -0.327081 0.504678
C 2.959017 -1.809281 0.920785
C 0.242689 0.438492 0.282988
C 1.592836 2.343898 -0.060711
C -2.490333 1.012716 0.018030
C -3.832595 0.365738 0.083582
C -4.436595 -0.115444 -1.088843
C -4.496359 0.239913 1.316329
C -5.696716 -0.706889 -0.979919
C -5.756807 -0.360474 1.384809
C -6.381013 -0.843899 0.231039
H 6.834258 -0.439425 -0.607911
H 5.574736 -0.964117 1.482959
H 5.312739 0.713464 0.901674
H 5.706952 -0.011282 -2.757078
H 4.104514 -0.220733 -2.047761
H 5.084482 1.163277 -1.585119
H 6.214695 -2.475165 -1.897910
H 6.097907 -2.819463 -0.170648
H 4.633780 -2.551844 -1.131637
H 3.492779 -2.719797 1.154211
H -2.270835 1.466378 -0.970772
H -2.369660 1.835707 0.752102
H -3.932801 -0.036164 -2.051344
H -4.023243 0.605728 2.226923
H 2.481838 4.195232 -0.314257
H 0.764937 4.207503 -0.411453
H -6.259489 -0.454390 2.348028
H -7.362134 -1.311602 0.278259


%chk=000241410-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241410

0 1
S -1.338276 -0.644944 0.337409
F -6.644555 -0.906261 -2.118001
N 3.703405 -0.613856 0.624628
N 1.754106 -1.835504 0.765747
N 2.750286 1.615613 0.134557
N 0.288603 1.557051 0.007367
N 1.484495 3.546757 -0.295354
C 5.899964 -0.614150 -0.672548
C 5.140519 -0.280468 0.643004
C 2.661390 0.283558 0.382413
C 5.283548 0.111867 -1.890195
C 6.009790 -2.136512 -0.922027
C 1.459908 -0.490261 0.471310
C 3.093923 -1.865983 0.850812
C 0.252520 0.225066 0.262031
C 1.518551 2.192907 -0.040947
C -2.519736 0.829513 0.008824
C -3.945769 0.344671 0.099660
C -4.636437 -0.067020 -1.068616
C -4.615840 0.296305 1.350821
C -5.964870 -0.504642 -0.948392
C -5.952806 -0.150912 1.436456
C -6.650747 -0.559326 0.276355
H 6.925982 -0.218476 -0.513912
H 5.607029 -0.814697 1.492111
H 5.204088 0.804812 0.840032
H 5.912316 -0.033253 -2.787476
H 4.276700 -0.284846 -2.115986
H 5.179674 1.195840 -1.704980
H 6.637545 -2.338263 -1.808917
H 6.465018 -2.661106 -0.060276
H 5.016140 -2.582031 -1.114113
H 3.680041 -2.752040 1.084755
H -2.260732 1.224247 -0.984804
H -2.277129 1.591419 0.764643
H -4.153289 -0.051806 -2.050626
H -4.083153 0.605922 2.256722
H 2.356552 4.065303 -0.343346
H 0.586953 4.001836 -0.431572
H -6.458074 -0.182360 2.407309
H -7.686728 -0.907875 0.313125


