%chk=000260994.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260994

0 1
S 3.028275 1.477224 -0.196369
O -1.747827 -0.053102 -1.710829
O 0.407487 -2.488321 0.176671
O 0.776575 2.111680 0.068261
N 0.912118 -0.190696 0.166407
N 3.180665 -1.141408 -0.043462
C -1.390205 -0.819466 0.468334
C -1.289527 0.762303 0.430053
C -2.240027 -1.108138 -0.820261
C -2.099154 1.096389 -0.874916
C -3.711725 -0.678417 -0.609846
C -3.612702 0.868613 -0.646444
C 0.046279 -1.352714 0.253464
C 0.196590 1.058137 0.198286
C -1.936536 -1.436221 1.737404
C -1.745255 1.510275 1.664340
C 2.306888 -0.157606 -0.009435
C 4.595419 0.721981 -0.328852
C 4.488388 -0.632484 -0.229489
H -2.060298 -2.071384 -1.309623
H -1.799804 2.004820 -1.407722
H -4.141932 -1.053194 0.330089
H -4.345185 -1.060152 -1.428137
H -4.195812 1.288898 -1.483068
H -3.987835 1.338660 0.274013
H -2.958748 -1.098542 1.953084
H -1.960938 -2.535218 1.663809
H -1.321697 -1.190797 2.614364
H -1.624780 2.597279 1.536154
H -2.803061 1.320921 1.891442
H -1.168470 1.227844 2.556018
H 5.484000 1.310341 -0.469609
H 5.290535 -1.363605 -0.276433


%chk=000260994-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260994

0 1
S 3.026262 0.444487 -1.651488
O -1.688253 0.189976 -1.721935
O 0.527359 -2.339017 -0.068116
O 0.601222 2.339221 0.344717
N 0.895504 -0.004959 0.148741
N 3.173358 -0.354237 0.894794
C -1.368206 -0.789976 0.417745
C -1.344352 0.788606 0.550540
C -2.174431 -0.979284 -0.922685
C -2.140014 1.223834 -0.737587
C -3.678787 -0.650037 -0.738320
C -3.654336 0.915373 -0.605839
C 0.093069 -1.188818 0.137904
C 0.129628 1.183473 0.343012
C -1.881582 -1.611085 1.615639
C -1.836031 1.415263 1.868839
C 2.295613 -0.013650 -0.030615
C 4.620094 0.123639 -0.909709
C 4.482288 -0.282329 0.408919
H -1.938690 -1.907816 -1.460396
H -1.874213 2.221333 -1.113287
H -4.131447 -1.155306 0.130479
H -4.233974 -0.963725 -1.637525
H -4.199123 1.392952 -1.436732
H -4.091977 1.279874 0.337850
H -2.916859 -1.341750 1.882666
H -1.847599 -2.687524 1.373071
H -1.250899 -1.452310 2.508041
H -1.770493 2.515492 1.806939
H -2.878962 1.136059 2.092345
H -1.211262 1.093047 2.720434
H 5.532490 0.260715 -1.485964
H 5.306307 -0.537617 1.075221


