%chk=000187635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187635

0 1
S -0.256355 1.457211 -0.322382
O -2.544557 -1.675381 -1.494333
O -0.395095 1.626247 -1.756275
O 0.737838 2.257942 0.379538
N 0.083178 -0.210587 -0.065810
C -1.241564 -2.076505 -0.951831
C -1.876360 -2.837814 -2.091711
C -0.094529 -1.117162 -1.225018
C 1.017419 -0.708277 0.984772
C -2.536872 -4.162574 -1.855137
C 2.466096 -0.726374 0.507741
C 0.868492 0.085477 2.284052
C -1.784745 1.675436 0.452007
C 3.095922 -1.963599 0.303245
C 3.178441 0.456574 0.273480
C -2.924577 1.038309 -0.045859
C -1.876829 2.508897 1.573148
C 4.423319 -2.014821 -0.131218
C 4.505115 0.402820 -0.162693
C -4.160794 1.232264 0.581797
C -3.109741 2.703567 2.198999
C 5.130325 -0.831343 -0.366083
C -4.252223 2.063587 1.701253
H -1.310737 -2.458168 0.071359
H -1.543216 -2.650272 -3.118584
H -0.300880 -0.526898 -2.158235
H 0.833580 -1.698914 -1.436930
H 0.698592 -1.770277 1.200230
H -1.802888 -4.978482 -1.842066
H -3.082715 -4.185844 -0.900644
H -3.273306 -4.386724 -2.640104
H 1.478428 -0.364602 3.077138
H -0.169444 0.106540 2.633706
H 1.212550 1.129909 2.184210
H 2.556816 -2.890586 0.486896
H 2.694231 1.430594 0.429178
H -2.862336 0.381218 -0.925904
H -0.981849 3.012889 1.956509
H 4.906865 -2.977070 -0.286374
H 5.050549 1.327691 -0.345315
H -5.047497 0.733049 0.193152
H -3.183658 3.353575 3.068803
H 6.163110 -0.870704 -0.705808
H -5.215400 2.216483 2.189104


%chk=000187635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187635

0 1
S -0.380680 1.472307 -0.425456
O -2.486747 -1.972310 -1.224772
O -0.769549 1.477830 -2.012703
O 0.753440 2.530993 0.108252
N -0.075268 -0.393613 0.020747
C -1.026226 -2.352500 -1.105624
C -1.815757 -2.820159 -2.294348
C -0.026980 -1.212479 -1.216944
C 0.963152 -0.702256 1.066232
C -2.316372 -4.240475 -2.432765
C 2.418391 -0.782859 0.577818
C 0.796480 0.186265 2.318826
C -1.946862 1.785784 0.581742
C 3.098709 -2.025945 0.636787
C 3.110936 0.354119 0.083835
C -3.050220 0.941767 0.369578
C -1.939861 2.882611 1.456680
C 4.445453 -2.139079 0.220438
C 4.454474 0.240492 -0.336596
C -4.226383 1.229147 1.101009
C -3.129031 3.148981 2.175702
C 5.127540 -1.002688 -0.269584
C -4.265299 2.325580 1.996429
H -0.851500 -3.075940 -0.295686
H -1.670926 -2.260988 -3.230253
H -0.305081 -0.567520 -2.074645
H 0.990402 -1.612537 -1.407697
H 0.668423 -1.732240 1.368512
H -1.593790 -4.850030 -3.007519
H -2.458779 -4.704509 -1.441663
H -3.283552 -4.264281 -2.966119
H 1.422945 -0.216254 3.133397
H -0.256359 0.186038 2.652376
H 1.112503 1.224618 2.127056
H 2.573956 -2.911970 1.019290
H 2.597793 1.322041 0.027678
H -2.994386 0.088965 -0.316520
H -1.040958 3.498147 1.564378
H 4.956467 -3.107059 0.275698
H 4.977330 1.125169 -0.717431
H -5.107735 0.592941 0.969298
H -3.164557 3.996903 2.867643
H 6.170390 -1.083914 -0.596529
H -5.183226 2.538205 2.555455


