data_							
_audit_creation_method	'generated by Material Studio 7 based on PXRD refinement results'								
_cell_length_a	18.67(1)						
_cell_length_b	24.31(3)						
_cell_length_c	14.01(4)						
_cell_angle_alpha	89.258(2)						
_cell_angle_beta	135.719(1)						
_cell_angle_gamma	90.789(2)						
							
_symmetry_space_group_name_H-M	'P	1'					
_symmetry_Int_Tables_number	1						
_symmetry_cell_setting	triclinic						
loop_							
_symmetry_equiv_pos_as_xyz							
"'+x,+y,+z'"							
							
loop_							
_atom_site_label							
_atom_site_type_symbol							
_atom_site_occupancy							
_atom_site_fract_x							
_atom_site_fract_y							
_atom_site_fract_z							
	C1	C	1	0.7506	0.3749	0.7881	
	C2	C	1	0.7704	0.3772	0.6366	
	C3	C	1	0.947	0.5731	0.9103	
	C4	C	1	0.5728	0.5762	0.5276	
	C5	C	1	0.76	0.6769	0.7204	
	C6	C	1	0.7603	0.4074	0.713	
	C7	C	1	0.7599	0.4714	0.7148	
	C8	C	1	0.8582	0.5912	0.5101	
	C9	C	1	0.8549	0.5908	0.4065	
	C10	C	1	0.7645	0.5756	0.2734	
	C11	C	1	0.6803	0.5602	0.2488	
	C12	C	1	0.6876	0.5601	0.3554	
	C13	C	1	0.6701	0.5971	0.9315	
	C14	C	1	0.6747	0.5989	0.0361	
	C15	C	1	0.758	0.5745	0.1638	
	C16	C	1	0.8337	0.5478	0.1818	
	C17	C	1	0.825	0.5459	0.0739	
	C18	C	1	0.7589	0.7408	0.7268	
	C19	C	1	0.7694	0.7777	0.6572	
	C20	C	1	0.7676	0.8368	0.6668	
	C21	C	1	0.7552	0.8603	0.7465	
	C22	C	1	0.7448	0.824	0.8151	
	C23	C	1	0.7466	0.7661	0.8054	
	C24	C	1	0.7534	0.9194	0.7561	
	C25	C	1	0.7639	0.9563	0.6865	
	C26	C	1	0.7761	0.931	0.6079	
	C27	C	1	0.778	0.8731	0.5982	
	C28	C	1	0.1357	0.1236	0.0126	
	C29	C	1	0.243	0.1225	0.1362	
	C30	C	1	0.277	0.1199	0.2645	
	C31	C	1	0.2026	0.118	0.2665	
	C32	C	1	0.0971	0.1189	0.1447	
	C33	C	1	0.3843	0.119	0.3881	
	C34	C	1	0.4594	0.1205	0.3859	
	C35	C	1	0.4228	0.1228	0.2559	
	C36	C	1	0.3173	0.1239	0.1341	
	C37	C	1	0.1334	0.5823	0.0256	
	C38	C	1	0.2407	0.5811	0.1491	
	C39	C	1	0.2747	0.5749	0.2771	
	C40	C	1	0.2004	0.5704	0.2788	
	C41	C	1	0.0949	0.5719	0.157	
	C42	C	1	0.382	0.5734	0.4006	
	C43	C	1	0.4572	0.5781	0.3988	
	C44	C	1	0.4205	0.5848	0.2694	
	C45	C	1	0.315	0.5861	0.1476	
	C46	C	1	0.7626	0.0164	0.7046	
	C47	C	1	0.751	0.3161	0.7868	
	C48	C	1	0.7709	0.3184	0.6353	
	C49	C	1	0.575	0.1199	0.5147	
	C50	C	1	0.9493	0.1175	0.8976	
	C51	C	1	0.7612	0.2859	0.7104	
	C52	C	1	0.7617	0.2219	0.7089	
	C53	C	1	0.8555	0.0991	0.496	
	C54	C	1	0.8514	0.0975	0.3918	
	C55	C	1	0.7651	0.1188	0.2614	
	C56	C	1	0.6861	0.1425	0.2403	
	C57	C	1	0.6944	0.1444	0.3479	
	C58	C	1	0.6672	0.098	0.9176	
	C59	C	1	0.6709	0.0983	0.0216	
	C60	C	1	0.7585	0.1177	0.1518	
	C61	C	1	0.8396	0.1373	0.1731	
	C62	C	1	0.8317	0.1375	0.066	
	C63	C	1	0.0583	0.5777	0.0274	
	C64	C	1	0.0605	0.1219	0.0147	
	H1	H	1	0.7421	0.3956	0.8526	
	H2	H	1	0.7786	0.3998	0.573	
	H3	H	1	0.9312	0.6044	0.6175	
	H4	H	1	0.9255	0.6026	0.4305	
	H5	H	1	0.6058	0.5479	0.1418	
	H6	H	1	0.619	0.5462	0.3345	
	H7	H	1	0.6032	0.6179	0.8288	
	H8	H	1	0.6108	0.6201	0.0173	
	H9	H	1	0.9022	0.5275	0.2843	
	H10	H	1	0.8861	0.5232	0.0889	
	H11	H	1	0.7794	0.7592	0.5926	
	H12	H	1	0.7346	0.8409	0.8808	
	H13	H	1	0.738	0.738	0.8623	
	H14	H	1	0.7432	0.9363	0.8218	
	H15	H	1	0.7851	0.9573	0.5491	
	H16	H	1	0.788	0.8546	0.5336	
	H17	H	1	0.1088	0.1259	0.9095	
	H18	H	1	0.2273	0.1158	0.3682	
	H19	H	1	0.0384	0.1171	0.1491	
	H20	H	1	0.409	0.117	0.4898	
	H21	H	1	0.4792	0.1239	0.2473	
	H22	H	1	0.2907	0.1259	0.0311	
	H23	H	1	0.1065	0.587	0.9227	
	H24	H	1	0.225	0.5654	0.3801	
	H25	H	1	0.0361	0.5684	0.1611	
	H26	H	1	0.4067	0.5682	0.502	
	H27	H	1	0.4769	0.5894	0.2612	
	H28	H	1	0.2883	0.5914	0.045	
	H29	H	1	0.7427	0.2935	0.8502	
	H30	H	1	0.7794	0.2977	0.5709	
	H31	H	1	0.9248	0.0808	0.6009	
	H32	H	1	0.918	0.079	0.4131	
	H33	H	1	0.6151	0.1601	0.1356	
	H34	H	1	0.6305	0.1648	0.3303	
	H35	H	1	0.5967	0.0815	0.8127	
	H36	H	1	0.6029	0.0829	0.0002	
	H37	H	1	0.9117	0.1532	0.2778	
	H38	H	1	0.8973	0.1548	0.0839	
	N1	N	1	0.7448	0.5709	0.952	
	N2	N	1	0.7749	0.5761	0.483	
	N3	N	1	0.7472	0.1174	0.9414	
	N4	N	1	0.7774	0.1223	0.4724	
	O1	O	1	0.8859	0.572	0.9234	
	O2	O	1	0.6098	0.5735	0.6473	
	O3	O	1	0.7499	0.6475	0.787	
	O4	O	1	0.75	0.4971	0.7848	
	O5	O	1	0.6341	0.5774	0.5147	
	O6	O	1	0.9099	0.5749	0.7903	
	O7	O	1	0.7696	0.4998	0.6467	
	O8	O	1	0.7707	0.6521	0.65	
	O9	O	1	0.7727	0.0457	0.6378	
	O10	O	1	0.7518	0.0412	0.7747	
	O11	O	1	0.6121	0.1183	0.6347	
	O12	O	1	0.8879	0.1163	0.9104	
	O13	O	1	0.7521	0.1935	0.7771	
	O14	O	1	0.9123	0.1199	0.7778	
	O15	O	1	0.6362	0.1209	0.5016	
	O16	O	1	0.7717	0.1962	0.639	
	O17	O	1	0.2739	0.6634	0.3927	
	O18	O	1	0.8421	0.3084	0.9760	
	O19	O	1	0.7030	0.6864	0.1105	
	O20	O	1	0.92	0.2849	0.2927	
	O21	O	1	0.9773	0.8826	0.2515	
	O22	O	1	0.4291	0.0551	0.7365	
	O23	O	1	0.2122	0.4151	0.6625	
	O24	O	1	0.2504	0.1958	0.9072	
	O25	O	1	0.935	0.8687	0.3341	
	O26	O	1	0.628	0.2145	0.8273	
	O27	O	1	0.2306	0.2806	0.8216	
	O28	O	1	0.6329	0.0762	0.278	
	O29	O	1	0.433	0.9418	0.2766	
	O30	O	1	0.736	0.0197	0.0017	
	O31	O	1	0.3487	0.8503	0.0336	
	O32	O	1	0.4793	0.3775	0.9507	
	O33	O	1	0.1397	0.0715	0.5069	
	O34	O	1	0.4199	0.5418	0.5577	
	O35	O	1	0.0874	0.7426	0.5426	
	O36	O	1	0.5028	0.12	0.9996	
	O37	O	1	0.3298	0.256	0.3358	
	O38	O	1	0.8968	0.208	0.5272	
	O39	O	1	0.9383	0.301	0.8202	
	Zn1	Zn	1	0.7469	0.572	0.8171	
	Zn2	Zn	1	0.7731	0.5762	0.6187	
	Zn3	Zn	1	0.749	0.1172	0.8058	
	Zn4	Zn	1	0.7753	0.1212	0.6075	
