%chk=000207480.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207480

0 1
S 0.299715 -0.143169 2.055550
S 2.304000 -0.560721 -1.840712
O 6.080188 -0.782587 -2.566474
O 4.319678 -0.814692 -3.833663
N -3.960730 0.375107 0.464922
N -0.413463 -0.324525 -0.424934
N 4.875579 -0.746617 -2.747447
C -2.900906 -0.245353 -0.392373
C -5.209008 -0.460326 0.470587
C -4.248596 1.791579 0.061225
C -1.593098 -0.208763 0.348011
C -6.079877 -0.089398 1.671486
C -3.034088 2.684836 0.307905
C -1.391126 -0.102871 1.699380
C 0.672114 -0.306729 0.330551
C 2.020776 -0.404305 -0.140218
C 3.206150 -0.394696 0.569563
C 4.352047 -0.514524 -0.268111
C 4.008822 -0.612770 -1.600905
H -2.786236 0.257430 -1.382295
H -3.133671 -1.312055 -0.625308
H -5.794278 -0.366450 -0.469796
H -4.911147 -1.529934 0.558242
H -4.575336 1.876431 -0.998383
H -5.098108 2.149292 0.687672
H -5.492083 -0.094095 2.599671
H -6.513629 0.912350 1.573346
H -6.903653 -0.800772 1.792461
H -2.648402 2.554597 1.328082
H -2.207009 2.458752 -0.375529
H -3.292404 3.741120 0.179345
H -2.153249 0.004793 2.458065
H 3.280852 -0.306691 1.647079
H 5.373076 -0.526644 0.102903


%chk=000207480-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207480

0 1
S 0.396377 -0.080476 2.124317
S 2.354930 -0.683078 -1.945517
O 6.146297 -1.875616 -2.387366
O 4.491131 -1.345666 -3.894494
N -3.850909 0.866275 0.395976
N -0.258411 0.127676 -0.461026
N 4.942983 -1.494721 -2.685276
C -2.645876 0.925232 -0.464277
C -4.366238 -0.529558 0.518028
C -4.898029 1.840670 -0.020851
C -1.394591 0.487836 0.267279
C -5.243694 -0.747927 1.764055
C -4.551073 3.295173 0.348392
C -1.246269 0.440901 1.649608
C 0.773975 -0.196162 0.314794
C 2.071624 -0.603700 -0.158704
C 3.213275 -0.967333 0.573283
C 4.329482 -1.314860 -0.240514
C 4.040953 -1.216393 -1.600033
H -2.496923 1.967113 -0.803568
H -2.741004 0.309792 -1.391542
H -4.927236 -0.831682 -0.401888
H -3.488679 -1.199063 0.585396
H -5.108444 1.765739 -1.117721
H -5.833145 1.562343 0.496163
H -4.681665 -0.489450 2.678825
H -6.162552 -0.134666 1.745025
H -5.553835 -1.807069 1.830409
H -4.386135 3.383161 1.436261
H -3.639428 3.652439 -0.164379
H -5.377701 3.970681 0.060190
H -2.002004 0.685682 2.391858
H 3.238692 -0.980591 1.665893
H 5.307027 -1.625102 0.131302


