13
cmpd2a
C -0.315105 0.223445 0.478351
C -1.774681 0.696481 0.100207
O -2.050084 1.879953 0.416594
O -2.487060 -0.159810 -0.491547
N -0.116162 -1.220441 0.249777
C 0.674167 1.046338 -0.353483
S 2.454184 0.678370 0.035031
H -0.150243 0.467039 1.537625
H -0.931166 -1.490271 -0.314712
H -0.226697 -1.716713 1.130568
H 0.523728 2.112768 -0.154191
H 0.516055 0.856615 -1.423091
H 2.264434 -0.669542 0.011255

