Dipole vector (in atomic units): -77.72 -4.85 4.34
Mass Moments vector: 644.00 586.57 758.92
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| No. of Chains=1 | Spherical | STRUCTURE OF BACE BOUND TO SCH743813 | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 3057. | 387. | 385.11 | 32. | 43. | -10. | 375. | 5598. | -0.0033 | 0.1225 |
| No.Dev.Units | 1.10 | 1.09 | 0.82 | 0.44 | 0.76 | -0.88 | -0.40 | 0.94 | -0.33 | -0.87 |
| Dipole vector (in atomic units): -77.72 -4.85 4.34 Mass Moments vector: 644.00 586.57 758.92
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