Dipole vector (in atomic units): 8.09 6.50 -1.42
Mass Moments vector: 1047.30 1566.37 1714.33
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| show separated chains | No. of Chains=2 | Elongated | STRUCTURE OF BACE BOUND TO SCH743641 | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 6112. | 779. | 849.13 | 64. | 86. | -22. | 50. | 5543. | -0.0036 | 0.0082 |
| No.Dev.Units | 3.70 | 3.71 | 3.90 | 2.35 | 2.94 | -2.45 | -1.18 | 0.92 | -0.39 | -1.28 |
| Dipole vector (in atomic units): 8.09 6.50 -1.42 Mass Moments vector: 1047.30 1566.37 1714.33
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