%chk=000227692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227692

0 1
S 2.193362 -1.243522 -0.370447
N -1.118760 -1.476272 0.092585
N -2.604225 0.269395 0.224048
N -0.926212 2.102760 -0.080876
N 1.367477 1.305412 -0.362004
C -0.364583 -0.310154 -0.058648
C -1.323483 0.791473 0.027316
C 0.991957 0.025058 -0.258031
C -2.456538 -1.076228 0.259108
C -0.606535 -2.847924 0.078252
C 0.390017 2.294241 -0.268839
C 3.754843 -0.382666 -0.619453
H -3.270255 -1.778594 0.399368
H -1.422375 -3.577060 0.221710
H -0.110040 -3.074143 -0.886685
H 0.136053 -3.000751 0.886962
H 0.755051 3.330365 -0.361352
H 4.550779 -1.133585 -0.697103
H 3.981763 0.297192 0.214683
H 3.742503 0.224703 -1.536194


%chk=000227692-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227692

0 1
S 2.286315 -1.335139 -0.378894
N -1.126616 -1.487176 0.093401
N -2.594223 0.286833 0.221135
N -0.911060 2.081577 -0.081988
N 1.387663 1.272678 -0.362951
C -0.356860 -0.326997 -0.059519
C -1.290280 0.770327 0.023316
C 1.013461 -0.026230 -0.258956
C -2.447411 -1.047865 0.255858
C -0.675580 -2.888003 0.089731
C 0.419897 2.251515 -0.270685
C 3.821507 -0.282576 -0.632749
H -3.263875 -1.754672 0.396454
H -1.551587 -3.539361 0.240208
H -0.201764 -3.145016 -0.872298
H 0.046878 -3.069094 0.902938
H 0.780911 3.279713 -0.362051
H 4.654596 -0.997972 -0.718412
H 3.956715 0.384548 0.229108
H 3.712112 0.312612 -1.549248


