%chk=000282514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282514

0 1
S -1.422221 -1.797273 -1.113302
S 0.294090 -1.807290 -0.004465
O -4.617897 -0.788778 -0.744878
O 1.427296 1.316858 -1.507826
O -3.703057 -1.228713 1.283891
O 1.639403 1.235543 0.748290
O -1.800899 3.022080 0.260890
O 5.319252 -1.051697 -0.536838
N -1.872461 0.854351 0.933281
N 3.312798 -0.996639 0.535918
C -2.691552 0.458337 -0.224500
C 2.598319 -0.551424 -0.671896
C -1.861678 -0.073821 -1.393180
C 1.642268 -1.619576 -1.196526
C -3.677840 -0.621892 0.243892
C 1.836450 0.740775 -0.335371
C -1.489430 2.192916 1.104767
C 4.706211 -1.191873 0.505825
C -0.695288 2.480826 2.336711
C 5.313442 -1.589999 1.816497
C -5.640824 -1.795692 -0.511009
C 0.790711 2.625768 -1.435272
H -3.277045 1.365086 -0.578890
H 3.363532 -0.314781 -1.481768
H -2.459213 -0.047957 -2.333067
H -0.972526 0.567309 -1.578544
H 1.271697 -1.346843 -2.206440
H 2.166224 -2.592547 -1.313872
H -1.568262 0.112332 1.564250
H 2.774508 -1.043082 1.398933
H -1.088662 2.000596 3.240682
H -0.658698 3.565388 2.525207
H 0.354377 2.145019 2.209425
H 5.201399 -0.810050 2.582956
H 6.396319 -1.763375 1.691364
H 4.884393 -2.518808 2.217040
H -6.333843 -1.627957 -1.342124
H -6.116223 -1.628213 0.461085
H -5.179465 -2.787304 -0.553479
H 1.038229 3.073171 -2.403154
H 1.189737 3.212612 -0.600933
H -0.291176 2.476020 -1.314570


%chk=000282514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282514

0 1
S -1.319908 -1.915730 -0.931737
S 0.530299 -1.318888 0.242031
O -4.846586 -1.140506 -0.729428
O 1.910422 1.798739 -1.693659
O -4.209631 -1.103848 1.511745
O 2.423743 1.878285 0.580396
O -1.373276 2.558996 -0.059438
O 4.693470 -2.319814 -0.536909
N -2.253814 0.724922 1.033715
N 3.571533 -0.581250 0.503634
C -3.021644 0.303328 -0.138778
C 2.911240 -0.156542 -0.735235
C -2.147202 -0.252013 -1.292693
C 1.788941 -1.126802 -1.181147
C -4.069123 -0.710777 0.331255
C 2.392619 1.272560 -0.520116
C -1.456758 1.847948 0.999005
C 4.455445 -1.649075 0.514943
C -0.682329 2.174360 2.263846
C 5.105347 -1.937277 1.864797
C -5.875244 -2.164207 -0.406123
C 1.350203 3.184431 -1.631347
H -3.547756 1.186976 -0.557580
H 3.651613 -0.148863 -1.560742
H -2.780389 -0.453139 -2.174073
H -1.373758 0.486208 -1.552010
H 1.257637 -0.723535 -2.056300
H 2.223652 -2.112411 -1.401546
H -2.361708 0.163021 1.882997
H 3.432193 0.019351 1.322720
H -0.909589 1.493090 3.101081
H -0.905338 3.210917 2.569680
H 0.397575 2.121008 2.037491
H 5.732976 -1.087991 2.192268
H 5.738991 -2.830744 1.769685
H 4.341806 -2.118264 2.642973
H -6.360377 -2.383930 -1.366586
H -6.595311 -1.758230 0.323300
H -5.391105 -3.060922 0.013958
H 1.188422 3.456892 -2.683460
H 2.080889 3.855637 -1.150444
H 0.404225 3.167489 -1.063173


