%chk=000223599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223599

0 1
S -1.419366 -1.889447 -0.266320
O -1.640286 -3.189549 0.330775
O -1.811619 -1.618915 -1.628790
N -2.283971 -0.835402 0.793282
C 0.224815 -1.412312 -0.044933
C 2.122454 0.021741 -0.554988
C 2.917979 -0.699997 0.374831
C 0.759884 -0.361660 -0.750707
C 1.023890 -2.140731 0.882416
C 2.335474 -1.794941 1.088805
C 2.702976 1.115774 -1.274494
C 4.282894 -0.313700 0.570392
C -2.595124 0.528191 0.554930
C 4.013246 1.463745 -1.067256
C 4.811991 0.738978 -0.132618
C -2.484225 1.098583 -0.727847
C -3.009663 1.322106 1.648551
C -2.761748 2.455333 -0.898886
C -3.284198 2.674079 1.450404
C -3.154216 3.250418 0.182062
H 0.159168 0.198497 -1.477356
H 0.577311 -2.986307 1.418555
H 2.953633 -2.348436 1.795002
H -2.670743 -1.229069 1.661867
H 2.083236 1.662170 -1.985884
H 4.887092 -0.871454 1.284821
H 4.465154 2.293929 -1.608733
H 5.850370 1.040052 0.009633
H -2.238393 0.486805 -1.600575
H -3.112079 0.887018 2.638388
H -2.679094 2.895370 -1.893123
H -3.602252 3.286874 2.293950
H -3.366289 4.305758 0.037046


%chk=000223599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223599

0 1
S -1.541369 -2.038488 -0.500154
O -1.710043 -3.542485 0.089834
O -1.842621 -1.641610 -2.044209
N -2.796510 -0.993420 0.564602
C 0.208400 -1.443817 -0.091501
C 2.064034 0.053438 -0.527176
C 2.789066 -0.576436 0.560768
C 0.743563 -0.408188 -0.844314
C 0.888006 -2.091378 0.977427
C 2.174890 -1.651183 1.289193
C 2.684315 1.117864 -1.260758
C 4.109459 -0.112622 0.871005
C -2.723144 0.419597 0.428115
C 3.971941 1.547151 -0.932600
C 4.689104 0.927515 0.140861
C -3.107606 1.008227 -0.810768
C -2.327242 1.254057 1.512847
C -3.095847 2.410388 -0.949931
C -2.357959 2.657268 1.372359
C -2.731680 3.241097 0.138718
H 0.178909 0.030174 -1.674449
H 0.415884 -2.929317 1.499977
H 2.736459 -2.133656 2.097226
H -2.650186 -1.346981 1.527769
H 2.132687 1.588664 -2.082345
H 4.660721 -0.588076 1.690679
H 4.440896 2.360332 -1.496651
H 5.698924 1.274490 0.384801
H -3.418421 0.356651 -1.632389
H -2.013328 0.801032 2.462047
H -3.393186 2.858715 -1.904308
H -2.075938 3.293735 2.218367
H -2.743877 4.330766 0.028159


