%chk=000270990.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270990

0 1
S 3.950736 1.051287 -1.000772
O 4.383117 2.435580 -0.903947
O 4.434669 0.236113 -2.081884
N 4.599368 0.452566 0.512237
N -1.973852 0.948792 -0.674715
N 3.519281 -1.621907 0.290263
N -2.617442 0.039221 -0.087118
N -6.290711 0.837290 -0.687003
N -4.492441 2.044820 -1.505380
N -8.176966 -0.256667 0.140155
C 2.247096 0.971496 -0.862947
C 1.549371 -0.138358 -1.354815
C 1.548814 2.034372 -0.269212
C -0.533345 0.874658 -0.662787
C 0.157913 -0.194845 -1.256081
C 0.162382 1.995760 -0.163749
C 4.410789 -0.845605 0.995869
C 5.082302 -1.318517 2.154087
C -4.019044 0.054359 -0.101183
C 4.826383 -2.619383 2.573818
C -4.914210 0.976789 -0.759893
C 3.298304 -2.887013 0.730462
C -4.607611 -1.006789 0.645579
C 3.926544 -3.424291 1.861688
C -5.972239 -1.149604 0.732488
C -6.798953 -0.195554 0.052895
H 2.097618 -0.971006 -1.816640
H 2.097403 2.906972 0.105732
H 5.261161 1.045968 1.030250
H -0.387351 -1.060224 -1.629603
H -0.384854 2.817726 0.295121
H 5.778366 -0.683864 2.691345
H 5.327907 -3.014915 3.458315
H -3.941520 -1.713722 1.153340
H 2.585754 -3.474495 0.138258
H 3.721781 -4.441818 2.176923
H -6.419114 -1.953168 1.305446
H -5.165650 2.653788 -1.947220
H -3.508526 2.248023 -1.637096
H -8.745529 0.379693 -0.398929
H -8.631799 -1.057527 0.538503


%chk=000270990-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270990

0 1
S 3.836789 0.702172 -1.174243
O 4.349967 2.227292 -1.437598
O 4.231026 -0.493425 -2.193042
N 4.558630 0.430466 0.530257
N -2.192788 1.025198 -0.502532
N 3.708102 -1.754800 0.751424
N -2.887189 -0.109027 -0.587992
N -6.416973 1.165661 -0.103985
N -4.415896 2.387361 -0.125821
N -8.431814 0.009472 -0.072984
C 1.979078 0.740971 -0.918277
C 1.254895 -0.461667 -1.005702
C 1.392517 2.000312 -0.709819
C -0.784120 0.858996 -0.651577
C -0.142651 -0.396300 -0.872575
C -0.008386 2.049008 -0.573205
C 4.652402 -0.836082 1.116422
C 5.659597 -1.109960 2.089827
C -4.266255 -0.023460 -0.452939
C 5.656608 -2.371059 2.713747
C -5.054885 1.187885 -0.224257
C 3.741969 -2.975255 1.355550
C -4.991711 -1.252042 -0.549016
C 4.683082 -3.332462 2.345102
C -6.378058 -1.280671 -0.428185
C -7.060451 -0.031169 -0.202577
H 1.783057 -1.406877 -1.156918
H 2.011156 2.902316 -0.677797
H 5.310428 1.118532 0.667943
H -0.759615 -1.296385 -0.932698
H -0.519952 3.002843 -0.410211
H 6.410435 -0.355011 2.344815
H 6.413463 -2.606027 3.469690
H -4.413563 -2.165419 -0.721311
H 2.977162 -3.687416 1.025282
H 4.658759 -4.326094 2.800652
H -6.940008 -2.216289 -0.501051
H -4.969493 3.229212 0.031945
H -3.375981 2.343976 -0.225395
H -8.874770 0.912753 0.084647
H -8.998661 -0.831528 -0.133792


