%chk=000210778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210778

1 1
S 2.206195 -1.032273 1.354684
O -3.892152 -0.682050 -0.556661
N -1.179418 -0.197538 0.404428
C 0.225611 0.534851 0.081437
C 0.060015 1.302731 -1.254472
C 0.508818 1.539760 1.221389
C -2.305085 0.837625 0.490457
C -1.516268 -1.197074 -0.705573
C 1.306899 2.147727 -1.558653
C 1.748071 2.397085 0.910691
C 1.260122 -0.532991 -0.023489
C -1.100827 -0.940884 1.721279
C 1.603251 3.132386 -0.424354
C -3.697762 0.194260 0.560713
C -2.941288 -1.755557 -0.583894
C 1.686989 -1.214691 -1.133743
C 2.747514 -2.152966 -0.867350
C 3.133115 -2.176521 0.438450
H -0.821867 1.979824 -1.212295
H -0.129654 0.610839 -2.099803
H 0.650550 1.034723 2.197966
H -0.352501 2.226436 1.361511
H -2.255591 1.493596 -0.418926
H -2.139815 1.503335 1.368874
H -0.775677 -2.031125 -0.699591
H -1.411190 -0.682898 -1.693394
H 1.155550 2.696931 -2.510484
H 2.184410 1.490316 -1.727742
H 2.662720 1.769716 0.897791
H 1.901870 3.126376 1.732457
H -0.741849 -0.288333 2.538591
H -2.083950 -1.340925 2.029465
H -0.409254 -1.804375 1.662729
H 2.534774 3.693565 -0.647114
H 0.808582 3.900948 -0.360535
H -3.877423 -0.347066 1.507250
H -4.500406 0.950501 0.415095
H -3.236752 -2.312358 -1.500413
H -3.077895 -2.409988 0.295415
H 1.302029 -1.082432 -2.138924
H 3.182423 -2.763350 -1.653758
H 3.901417 -2.780834 0.902602


%chk=000210778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210778

1 1
S 2.312432 -0.965818 1.484425
O -4.043682 -0.629721 -0.525203
N -1.245468 -0.225070 0.398420
C 0.285804 0.556002 0.051830
C 0.154107 1.277462 -1.318098
C 0.513234 1.603964 1.171790
C -2.366038 0.805940 0.626271
C -1.643295 -1.107548 -0.795711
C 1.392469 2.175950 -1.604819
C 1.756672 2.494490 0.881842
C 1.323050 -0.530969 0.013231
C -1.087255 -1.085425 1.641427
C 1.625820 3.204650 -0.480375
C -3.770278 0.162802 0.673858
C -3.052922 -1.704094 -0.644942
C 1.734305 -1.307922 -1.071484
C 2.786738 -2.241491 -0.776571
C 3.208382 -2.190778 0.542700
H -0.739696 1.929321 -1.316336
H 0.042467 0.563757 -2.151242
H 0.637258 1.125165 2.160627
H -0.358456 2.280216 1.228333
H -2.324231 1.522835 -0.207411
H -2.166710 1.330839 1.573772
H -0.876234 -1.891267 -0.903905
H -1.643239 -0.463186 -1.686928
H 1.227554 2.685774 -2.571567
H 2.290043 1.540378 -1.723432
H 2.676151 1.881014 0.900771
H 1.847029 3.232361 1.699737
H -0.690262 -0.475211 2.464620
H -2.062816 -1.493783 1.940290
H -0.394623 -1.910766 1.429395
H 2.538991 3.790082 -0.689986
H 0.785110 3.927126 -0.450278
H -3.912770 -0.452644 1.586586
H -4.522194 0.968151 0.683729
H -3.309266 -2.249219 -1.567200
H -3.132266 -2.408908 0.208004
H 1.317526 -1.202570 -2.076719
H 3.222438 -2.917297 -1.515022
H 3.988421 -2.767290 1.037681


