%chk=000210360.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210360

0 1
S 6.890646 0.042639 -1.340983
S 7.571269 -0.817608 0.398535
O -6.886211 -0.921923 -0.429924
O 6.323327 -1.922215 0.602327
O 8.731213 -1.599406 0.130183
O 7.470059 0.113211 1.468780
N 3.098115 0.996601 -0.222885
C -0.707198 0.551095 -0.023217
C 0.667724 1.196776 0.180795
C -1.833747 1.452232 0.507798
C 1.785614 0.290446 -0.359465
C -3.176507 0.807335 0.301041
C 4.244156 0.121641 -0.624065
C -3.745535 0.013244 1.302538
C -3.868510 0.991224 -0.912811
C 5.467304 1.024911 -0.768036
C -4.992382 -0.596471 1.119115
C -5.106315 0.397885 -1.121247
C -5.660615 -0.396310 -0.093776
C -7.571727 -1.759601 0.555085
C -8.857834 -2.139791 -0.152174
H -0.749493 -0.432762 0.483534
H -0.876158 0.342038 -1.098053
H 0.709934 2.179900 -0.331754
H 0.831369 1.412187 1.254006
H -1.669890 1.671401 1.582138
H -1.798917 2.439482 0.003450
H 1.619503 0.089910 -1.441921
H 1.764519 -0.694052 0.156137
H 3.226705 1.303804 0.748703
H 4.004902 -0.362701 -1.598807
H 4.439115 -0.707496 0.097457
H -3.216078 -0.138001 2.242840
H -3.427097 1.605911 -1.697249
H 5.290280 1.813154 -1.533625
H 5.708468 1.561807 0.173131
H -5.413975 -1.205508 1.909918
H -5.656841 0.528746 -2.049610
H -7.744623 -1.158682 1.464141
H -6.931956 -2.630468 0.777671
H -9.440437 -1.248203 -0.424250
H -8.652659 -2.674816 -1.090215
H -9.486543 -2.780087 0.476005
H 6.570323 -2.837579 0.815640


%chk=000210360-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210360

0 1
S 6.970285 0.100591 -1.561198
S 7.971307 -0.550044 0.619498
O -7.137982 -0.771770 -0.433216
O 7.569701 -2.366915 0.514723
O 9.578315 -0.421639 0.755628
O 7.035842 0.104357 1.777164
N 3.094194 0.706761 -0.260772
C -0.765966 0.495958 -0.112577
C 0.655309 1.062949 0.095611
C -1.868580 1.408377 0.493153
C 1.749291 0.144167 -0.482199
C -3.269134 0.847830 0.293656
C 4.242522 -0.021812 -0.812951
C -3.857923 -0.012671 1.250571
C -4.012823 1.134879 -0.883437
C 5.471971 0.904669 -0.786854
C -5.139522 -0.578465 1.056697
C -5.289650 0.584141 -1.097493
C -5.859020 -0.277927 -0.126664
C -7.779870 -1.671319 0.544605
C -9.142434 -2.048332 -0.031058
H -0.841883 -0.511204 0.344623
H -0.962627 0.362353 -1.195397
H 0.740334 2.061558 -0.375802
H 0.833546 1.207810 1.182821
H -1.662557 1.539503 1.574171
H -1.790261 2.412269 0.030615
H 1.602640 0.028244 -1.574659
H 1.646499 -0.876831 -0.038231
H 3.244001 1.048692 0.697401
H 4.004009 -0.302943 -1.856596
H 4.486366 -0.964940 -0.270326
H -3.309686 -0.245688 2.172347
H -3.586940 1.805420 -1.640407
H 5.288682 1.852914 -1.325313
H 5.746657 1.152121 0.260448
H -5.559672 -1.235202 1.824322
H -5.866002 0.808478 -2.000515
H -7.885183 -1.146810 1.517025
H -7.144057 -2.568582 0.694753
H -9.762243 -1.148479 -0.183991
H -9.026519 -2.558557 -1.002411
H -9.673480 -2.727014 0.661033
H 8.205840 -2.843000 1.128104


