%chk=000258841.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258841

0 1
S 1.547455 -3.206744 0.334796
O -0.904544 2.036859 1.267828
O -3.453985 2.412274 0.500469
O -4.626312 0.636156 -1.147187
N 0.289893 -0.787345 0.687103
N -0.916094 -2.317585 -0.534004
N -2.911867 -0.874529 -0.941329
N -2.704428 1.360119 -0.029294
C -0.923180 -0.167100 0.318268
C 1.377841 -0.123640 1.432992
C -1.643583 -1.142876 -0.429143
C 0.255984 -2.059538 0.144640
C 2.330660 0.582193 0.497481
C -1.420834 1.152512 0.627635
C -3.525535 0.394204 -0.712326
C 2.079547 1.912111 0.130148
C 3.464681 -0.079568 0.007361
C 2.962368 2.575923 -0.725159
C 4.343971 0.590224 -0.848536
C 4.094537 1.916553 -1.215425
C 0.789611 -4.759115 -0.169302
H 0.916403 0.613940 2.144848
H 1.907791 -0.878868 2.062099
H -3.422156 -1.590176 -1.467785
H 1.193273 2.428563 0.512892
H 3.665891 -1.112947 0.286059
H 2.766617 3.609044 -1.009848
H 5.224326 0.075865 -1.231017
H 4.781063 2.435646 -1.882478
H 0.337648 -4.687420 -1.171788
H -0.002468 -5.074641 0.523382
H 1.572603 -5.528736 -0.191706
H -3.408476 3.149339 -0.206873


%chk=000258841-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258841

0 1
S 1.577537 -3.185612 0.353633
O -0.908398 2.137795 1.282860
O -3.445509 2.566523 0.294336
O -4.727738 0.674611 -1.028421
N 0.277657 -0.726224 0.682739
N -0.948797 -2.283372 -0.473170
N -2.944271 -0.867566 -0.833932
N -2.789219 1.309759 0.088437
C -0.948193 -0.117963 0.343813
C 1.412247 -0.084069 1.408651
C -1.662537 -1.107247 -0.354237
C 0.226335 -2.014238 0.164620
C 2.418509 0.598959 0.486461
C -1.464645 1.200069 0.646665
C -3.560923 0.363117 -0.628837
C 2.191176 1.930616 0.053019
C 3.589034 -0.079652 0.064244
C 3.117831 2.565701 -0.803132
C 4.515626 0.557193 -0.791834
C 4.280154 1.880909 -1.229464
C 0.696368 -4.730974 -0.270714
H 0.960028 0.650218 2.094865
H 1.896303 -0.879420 2.004289
H -3.463513 -1.583308 -1.345120
H 1.295311 2.461321 0.396526
H 3.778337 -1.104888 0.404748
H 2.936801 3.595177 -1.131489
H 5.418452 0.025426 -1.112191
H 4.999248 2.376834 -1.891158
H 0.354169 -4.557963 -1.299379
H -0.156554 -4.957304 0.383305
H 1.452577 -5.529420 -0.230126
H -4.334702 2.405688 -0.165208


