%chk=000257489.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257489

0 1
S 0.868073 -1.851515 -0.027341
O 0.958530 -2.595789 1.220435
O 0.947845 -2.549511 -1.302665
O -4.868370 1.371814 -1.177554
O -4.997613 1.490197 1.050643
N 4.875714 2.492542 0.036221
C -0.666999 -0.994505 -0.006146
C 2.037544 -0.593574 -0.009074
C -1.259613 -0.668060 1.214211
C -1.289035 -0.663625 -1.210102
C 2.540611 -0.115158 1.209579
C 2.528910 -0.068918 -1.213311
C -3.090294 0.373551 0.024748
C -2.475068 0.023032 1.236230
C -2.505661 0.027186 -1.200791
C 3.493445 0.893270 1.241718
C 3.481683 0.940141 -1.216150
C 3.968311 1.437610 0.020409
C -4.376552 1.112524 0.083894
H -0.786794 -0.966141 2.156679
H -0.838329 -0.958099 -2.164699
H 2.185037 -0.551048 2.151583
H 2.164096 -0.468521 -2.167749
H -2.950523 0.287256 2.184946
H -3.004122 0.293544 -2.136829
H 3.870826 1.260256 2.191354
H 3.850127 1.343019 -2.154629
H 5.352661 2.731604 0.888825
H 5.345043 2.763682 -0.810959
H -5.734484 1.863436 -1.148878


%chk=000257489-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257489

0 1
S 0.858450 -1.833217 -0.020914
O 0.949101 -2.620403 1.413742
O 0.946232 -2.580703 -1.477039
O -5.117705 1.318924 -1.207314
O -5.213837 1.358714 1.112788
N 5.199988 2.404187 0.033087
C -0.814402 -0.918031 -0.007712
C 2.172624 -0.495566 -0.003985
C -1.406098 -0.641008 1.235488
C -1.411424 -0.619512 -1.242659
C 2.670747 -0.057906 1.236108
C 2.670582 -0.026250 -1.232488
C -3.280061 0.352587 0.007507
C -2.656961 0.009656 1.236378
C -2.663530 0.031082 -1.229918
C 3.683902 0.916372 1.246968
C 3.683818 0.947934 -1.218462
C 4.200010 1.439405 0.020736
C -4.599863 1.041700 0.066590
H -0.913620 -0.952599 2.162231
H -0.921535 -0.915076 -2.176068
H 2.290706 -0.493660 2.166174
H 2.290249 -0.437978 -2.173325
H -3.167837 0.253756 2.173112
H -3.171065 0.286733 -2.163536
H 4.088692 1.270539 2.201961
H 4.088643 1.326412 -2.164088
H 5.582704 2.749104 0.908843
H 5.582875 2.771321 -0.833506
H -5.996387 1.773681 -1.106103


