Dipole moment for 1r9u: REFINED STRUCTURE OF PEPTAIBOL ZERVAMICIN IIB IN METHAN FROM TRANS-HYDROGEN BOND J COUPLINGS

No. of Chains=1Elongated REFINED STRUCTURE OF PEPTAIBOL ZERVAMICIN IIB IN METHAN FROM TRANS-HYDROGEN BOND J COUPLIN
No.AtomsNo.Res.RMPos.Res.Neg.Res.ChargeDipoleQuadrapoleCrg./Nat.Dip./Nat.
Value 99. 8. 25.30 0. -0. -0. 150. 214.-0.0000 1.5123
No.Dev.Units -1.42 -1.45 -1.57 -1.47 -1.42 0.43 -0.94 -0.67 0.25 4.05
Dipole vector (in atomic units): -26.49 5.24 15.57
Mass Moments vector: 48.24 27.18 51.93
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