Dipole vector (in atomic units): -102.61 -14.84 94.37
Mass Moments vector: 1062.99 895.06 621.27
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| show separated chains | No. of Chains=3 | Elongated | THE CRYSTAL STRUCTURE OF THE BET3-TRS31-SEDLIN COMPLEX. | |||||||
|---|---|---|---|---|---|---|---|---|---|---|
| No.Atoms | No.Res. | RM | Pos.Res. | Neg.Res. | Charge | Dipole | Quadrapole | Crg./Nat. | Dip./Nat. | |
| Value | 3647. | 460. | 507.40 | 49. | 62. | -11. | 673. | 7872. | -0.0030 | 0.1846 |
| No.Dev.Units | 1.60 | 1.58 | 1.63 | 1.45 | 1.73 | -1.01 | 0.31 | 1.62 | -0.28 | -0.65 |
| Dipole vector (in atomic units): -102.61 -14.84 94.37 Mass Moments vector: 1062.99 895.06 621.27
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