%chk=000270631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270631

0 1
S -1.792929 1.945041 -0.348292
O -2.391611 -1.761923 1.913737
O -5.449467 -0.658847 -1.863813
O -3.511712 -0.212279 -2.898587
O 1.848510 -0.178457 2.171341
O 4.212032 0.547028 -2.053949
O 6.207052 1.426507 -1.559487
N -2.420124 -0.630435 -0.213115
N 0.589989 -1.215855 0.582806
N 3.229298 1.672970 0.258699
C -1.221338 0.222896 -0.493941
C -3.603374 1.546433 -0.135317
C -3.722430 0.015355 -0.421120
C -0.546660 -0.338453 0.795050
C -1.905020 -1.080104 1.072505
C -4.360544 2.409644 -1.120286
C -3.965851 1.850860 1.305412
C -4.126448 -0.273730 -1.867027
C 1.761758 -1.074676 1.349398
C 2.856446 -2.073404 1.050794
C 3.944466 -1.434357 0.176515
C 4.717981 -0.322888 0.896509
C 4.586206 1.079839 0.265180
C 5.125175 1.072063 -1.162415
H -0.730547 0.032923 -1.465556
H -4.491606 -0.453678 0.261146
H -0.318542 0.430772 1.581609
H -4.301330 3.477583 -0.862095
H -5.429984 2.153847 -1.146941
H -3.975762 2.326302 -2.149886
H -3.429158 1.219809 2.026863
H -5.040815 1.713708 1.491773
H -3.735466 2.892609 1.576238
H 0.491161 -1.940029 -0.123978
H 2.475616 -2.995719 0.570217
H 3.290933 -2.411339 2.019294
H -5.790747 -0.888111 -2.769746
H 4.650969 -2.227669 -0.143485
H 3.495324 -1.055961 -0.768732
H 5.791424 -0.592352 0.957396
H 4.380385 -0.246140 1.955375
H 5.246060 1.790174 0.850428
H 2.828133 1.653633 1.200271
H 2.600849 1.144664 -0.343868
H 4.532798 0.587644 -2.994520


%chk=000270631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270631

0 1
S -2.705330 1.640738 -1.376571
O -1.888635 -0.998355 2.320422
O -6.441914 -1.011688 -0.293917
O -4.772234 -1.429217 -1.859260
O 1.861577 0.700106 -0.306172
O 7.078172 1.614805 -0.538520
O 7.371762 -0.611825 0.035555
N -2.886411 -0.589100 0.134411
N 0.327865 -1.036613 -0.192288
N 4.631839 1.818405 0.675459
C -1.997909 -0.071131 -0.933050
C -4.221085 1.440633 -0.159823
C -4.264262 -0.115723 0.186464
C -0.793137 -0.168427 0.086875
C -1.866885 -0.665717 1.122959
C -5.480359 1.958721 -0.878602
C -3.934588 2.236997 1.131213
C -5.133992 -0.919057 -0.780325
C 1.620476 -0.544118 -0.356996
C 2.695041 -1.607295 -0.619744
C 4.118488 -1.021917 -0.533857
C 4.542740 -0.645281 0.912655
C 5.423830 0.631665 0.978270
C 6.690553 0.435664 0.119370
H -1.941592 -0.681195 -1.844950
H -4.663019 -0.240009 1.207534
H -0.396097 0.829892 0.340224
H -5.387624 3.042177 -1.068826
H -6.374551 1.797250 -0.248504
H -5.632365 1.457439 -1.849356
H -3.071418 1.826187 1.683283
H -4.817954 2.216734 1.799235
H -3.706633 3.288757 0.889385
H 0.179674 -2.047866 -0.211186
H 2.519015 -2.027371 -1.631257
H 2.571316 -2.445575 0.095446
H -7.007198 -1.516683 -0.940307
H 4.837223 -1.749857 -0.951542
H 4.156263 -0.123585 -1.178384
H 5.087530 -1.485459 1.377349
H 3.654579 -0.436161 1.537409
H 5.832412 0.689108 2.016028
H 3.716278 1.642931 0.248174
H 5.143984 2.621182 0.311201
H 7.925674 1.445731 -1.033083


