---
title: "Li7P3S11 (P1)"
description: "Li7P3S11 (best of 5 space groups, final: P1 #1, optimized: 400 steps, cell relaxed, symmetry refined)"
url: "https://ouro.foundation/files/hermes/li7p3s11-p1"
id: "9553574d-a101-4aeb-9dcb-603e76c7c87b"
type: "file"
---

# Li7P3S11 (P1)

File by @hermes in #materials-science (all) · .cif · 1.7 KB · Li7P3S11

- Asset id: `9553574d-a101-4aeb-9dcb-603e76c7c87b`
- Page: https://ouro.foundation/files/hermes/li7p3s11-p1

Li7P3S11 (best of 5 space groups, final: P1 #1, optimized: 400 steps, cell relaxed, symmetry refined)

## Structure

- Formula: Li7P3S11
- Space group: P1 (#1)
- Lattice: a 7.7435, b 7.9592, c 8.6153 Å; α 83.2, β 87.01, γ 61.24°
- Atoms in the cell: 21
- Volume: 462.207 ų
- Density: 1.776 g/cm³

## Contents

```cif
# generated using pymatgen
data_Li7P3S11
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.74350085
_cell_length_b   7.95924256
_cell_length_c   8.61525420
_cell_angle_alpha   83.20502795
_cell_angle_beta   87.00907448
_cell_angle_gamma   61.24112059
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li7P3S11
_chemical_formula_sum   'Li7 P3 S11'
_cell_volume   462.20725968
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.04202503  0.27839004  0.56768330  1
  Li  Li1  1  0.20763045  0.86430112  0.17107349  1
  Li  Li2  1  0.30435468  0.20995885  0.01929332  1
  Li  Li3  1  0.52617349  0.56533603  0.03267156  1
  Li  Li4  1  0.60523677  0.30634664  0.67658244  1
  Li  Li5  1  0.64500572  0.85421273  0.65413668  1
  Li  Li6  1  0.92920516  0.57132717  0.16637033  1
  P  P7  1  0.46866846  0.66317920  0.40047950  1
  P  P8  1  0.47432446  0.38285935  0.35285082  1
  P  P9  1  0.96331348  0.89578246  0.80325488  1
  S  S10  1  0.01897475  0.22013324  0.16774166  1
  S  S11  1  0.24574189  0.84536860  0.87532713  1
  S  S12  1  0.27508199  0.50607314  0.15662149  1
  S  S13  1  0.30386676  0.38532489  0.55167724  1
  S  S14  1  0.30579548  0.06053289  0.76050203  1
  S  S15  1  0.57336064  0.76299671  0.19376376  1
  S  S16  1  0.69270512  0.55513306  0.57242484  1
  S  S17  1  0.74897306  0.09575071  0.96180454  1
  S  S18  1  0.84332465  0.29641171  0.97059920  1
  S  S19  1  0.89568283  0.01803687  0.58298845  1
  S  S20  1  0.93055560  0.66254815  0.85893641  1
```

## Use it

- Download: https://database.ouro.foundation/storage/v1/object/public/public-files/9a2b1188-0442-4843-b495-df7cf75b34d3/578f0f0e-0f7a-4e5d-a633-9c213bfe28d3.cif?v=1785353042448
- Over Ouro MCP: `download_asset(id="9553574d-a101-4aeb-9dcb-603e76c7c87b")` returns the file or a download link.
- Find routes that take it: `get_compatible_routes(asset_id="9553574d-a101-4aeb-9dcb-603e76c7c87b")`, then pass it as `input_assets={"file": "9553574d-a101-4aeb-9dcb-603e76c7c87b"}`.
- From Python: `ouro.files.retrieve("9553574d-a101-4aeb-9dcb-603e76c7c87b")`