%chk=000270934.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270934

0 1
S -5.135141 -0.108667 0.203177
O 1.832465 -2.480039 1.541886
N 3.781855 0.440637 0.330838
N -0.221203 -0.925480 0.019010
N -2.252586 -1.478196 0.947127
N -1.010551 0.874482 -1.547269
N -3.429358 1.216578 -1.397320
C 2.051300 -1.164273 1.013768
C 3.562464 -0.976911 0.747757
C 1.221774 -0.946247 -0.266549
C 4.902331 0.568978 -0.658137
C 3.987153 1.333232 1.521797
C -1.165903 -0.094933 -0.585812
C -0.939325 -1.745618 0.943645
C 4.458282 0.051676 -2.026684
C 3.651624 2.775637 1.143137
C -2.440383 -0.455575 0.007157
C -3.567179 0.260514 -0.456325
C -2.166101 1.481867 -1.900003
C -6.256528 1.012466 -0.650282
H 1.693081 -0.515334 1.848599
H 4.126644 -1.274284 1.658863
H 3.895436 -1.672644 -0.051873
H 1.437725 -1.731550 -1.025018
H 1.519655 0.035221 -0.733868
H 5.158749 1.650322 -0.745892
H 5.828517 0.049965 -0.330524
H 3.303773 1.004201 2.336502
H 5.018263 1.271693 1.931961
H -0.423486 -2.479188 1.561388
H 5.210432 0.275132 -2.791489
H 3.517502 0.526736 -2.339588
H 4.292043 -1.030300 -2.029805
H 3.633170 3.420535 2.027977
H 2.664489 2.836812 0.662357
H 4.374379 3.196588 0.435047
H 2.129077 -3.175247 0.923097
H -2.111661 2.271473 -2.666732
H -5.995753 2.064943 -0.473529
H -7.270214 0.828054 -0.274502
H -6.244010 0.854644 -1.737389


%chk=000270934-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270934

0 1
S -5.126522 -0.186867 0.112322
O 1.916928 -2.527913 1.757306
N 3.686151 0.451041 0.181057
N -0.191267 -1.258213 -0.106392
N -2.311740 -1.974196 0.435548
N -0.727004 1.038920 -0.872613
N -3.130617 1.511642 -0.751868
C 2.032121 -1.233728 1.053964
C 3.522168 -0.853815 0.855400
C 1.267896 -1.240064 -0.284281
C 4.937993 0.570754 -0.613418
C 3.452136 1.620483 1.076777
C -1.049282 -0.191410 -0.385827
C -1.003212 -2.291226 0.389580
C 4.914767 -0.245626 -1.919704
C 2.832989 2.816693 0.328010
C -2.362078 -0.655409 -0.049311
C -3.417004 0.271003 -0.261642
C -1.825555 1.832552 -1.027742
C -6.002251 1.408747 -0.367992
H 1.540657 -0.526208 1.742913
H 4.018300 -0.899844 1.855131
H 3.997651 -1.634537 0.227274
H 1.577258 -2.110344 -0.895701
H 1.527381 -0.316104 -0.830411
H 5.057580 1.638429 -0.872117
H 5.835965 0.290494 -0.006323
H 2.758878 1.308029 1.879355
H 4.398526 1.928860 1.584993
H -0.580042 -3.236687 0.719129
H 5.843176 -0.072703 -2.494809
H 4.053523 0.055581 -2.541291
H 4.841891 -1.333279 -1.734093
H 2.671802 3.664972 1.019576
H 1.863698 2.526158 -0.113961
H 3.489014 3.170524 -0.488577
H 2.483460 -3.194851 1.288659
H -1.651495 2.840518 -1.414704
H -5.629504 2.237626 0.249074
H -7.070331 1.220707 -0.177553
H -5.821203 1.627187 -1.429239


