XLOGP3-AA of MOL : 1.35 -------------------------------------------------- + Contribution from Each Atom: 1 S.3: 0.844 2 O.2.(=C): 0.641 3 O.2.(=C): 0.641 4 O.2.(=C): 0.641 5 O.2.(=C): 0.641 6 O.2.(=C): 0.641 7 O.2.(=C): 0.641 8 N.am: -0.105 9 N.am.h: -0.272 10 N.am.h: -0.272 11 N.am: -0.105 12 N.am.h: -0.272 13 C.3.h.X: -0.144 14 C.3.X: -0.439 15 C.3.h.X.pi: -0.342 16 C.3.h.X.pi: -0.342 17 C.2.(=X).X: -0.760 18 C.3.3h: 0.480 19 C.3.3h: 0.480 20 C.2.(=X).X: -0.760 21 C.2.(=X).X: -0.760 22 C.3.h.X.pi: -0.342 23 C.ar: 0.172 24 C.2.(=X).X: -0.760 25 C.ar.h: 0.320 26 C.ar.h: 0.320 27 C.3.2h.X: -0.097 28 C.3.2h.X: -0.097 29 C.2.(=X).X: -0.760 30 C.ar.h: 0.320 31 C.ar.h: 0.320 32 C.ar.h: 0.320 + Contribution from 'Hydrogen Bond' Correction: 0.551