%chk=000291128.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291128

0 1
S -0.005398 1.819906 -0.000034
N 0.003310 -1.310387 0.000268
N -3.785799 0.559372 -0.000038
C 1.262153 -0.653792 0.000040
C -1.243234 -0.665866 -0.000035
C 1.379385 0.747423 -0.000062
C -1.371990 0.737705 -0.000040
C 2.426405 -1.449625 0.000069
C 2.636615 1.351730 -0.000126
C -2.419193 -1.449092 -0.000132
C -2.650694 1.308750 -0.000018
C 3.679578 -0.834125 0.000005
C 3.789954 0.559677 -0.000093
C -3.656936 -0.794012 -0.000139
H 0.009851 -2.330084 -0.000394
H 2.357446 -2.534553 0.000168
H 2.727187 2.440320 -0.000196
H -2.376135 -2.533135 -0.000126
H -2.795658 2.398118 0.000079
H 4.579187 -1.450516 0.000049
H 4.770709 1.030924 -0.000144
H -4.594645 -1.364138 -0.000099


%chk=000291128-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291128

0 1
S -0.015042 1.936475 0.000169
N 0.002204 -1.266184 0.000190
N -3.866786 0.531261 -0.000177
C 1.268974 -0.634535 0.000081
C -1.255780 -0.652393 0.000058
C 1.412534 0.780542 0.000051
C -1.420659 0.763297 0.000044
C 2.431824 -1.444470 0.000018
C 2.701336 1.353433 -0.000062
C -2.431069 -1.448102 -0.000047
C -2.729160 1.291493 -0.000075
C 3.719480 -0.865794 -0.000095
C 3.858431 0.539432 -0.000134
C -3.695189 -0.823000 -0.000163
H 0.009395 -2.286797 -0.000039
H 2.320845 -2.536643 0.000063
H 2.802420 2.445020 -0.000097
H -2.356746 -2.542343 -0.000043
H -2.879346 2.377573 -0.000103
H 4.604212 -1.511080 -0.000148
H 4.850025 1.002878 -0.000217
H -4.609806 -1.425464 -0.000273


