# --------------------------------------------------------------------------
#
# CIF file generated by openbabel 2.3.2 http://openbabel.org/
# to comply with the Macromolecular CIF Dictionary  (cif_mm.dic) version  2.0.11 http://mmcif.pdb.org/
# The contents of this file were derived from PLPI35.gro
#
#---------------------------------------------------------------------------

data_PLPI35

###########
## ENTRY ##
###########

_entry.id	PLPI35

##############
## CHEMICAL ##
##############

_chemical.entry_id	PLPI35
_chemical.name_common	'PLPI35'

######################
## CHEMICAL FORMULA ##
######################

_chemical_formula.entry_id	PLPI35
_chemical_formula.structural	'C43H86O22P4'

###############
## ATOM_SITE ##
###############

loop_
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_comp_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
	1	C	C12	PLPI35	1	1
	32.45	37.26	62.63
	2	H	H2	PLPI35	1	1
	33.29	37.62	61.99
	3	O	O2	PLPI35	1	1
	32.66	35.9	62.88
	4	H	HO2	PLPI35	1	1
	33.08	35.51	62.14
	5	C	C13	PLPI35	1	1
	32.44	38.09	63.9
	6	H	H3	PLPI35	1	1
	32.26	39.17	63.67
	7	O	O3	PLPI35	1	1
	33.7	37.9	64.53
	8	P	P3	PLPI35	1	1
	34.88	39.01	64.49
	9	O	OP32	PLPI35	1	1
	35.08	39.3	63.01
	10	O	OP33	PLPI35	1	1
	36.09	38.34	65.1
	11	O	OP34	PLPI35	1	1
	34.49	40.23	65.28
	12	C	C14	PLPI35	1	1
	31.3	37.64	64.79
	13	H	H4	PLPI35	1	1
	31.41	36.55	65.06
	14	O	O4	PLPI35	1	1
	31.34	38.43	65.99
	15	P	P4	PLPI35	1	1
	31.57	37.83	67.54
	16	O	OP42	PLPI35	1	1
	30.44	36.95	68.13
	17	O	OP43	PLPI35	1	1
	31.66	39.03	68.45
	18	O	OP44	PLPI35	1	1
	32.88	37.08	67.72
	19	C	C15	PLPI35	1	1
	30.02	37.77	63.96
	20	H	H5	PLPI35	1	1
	29.89	38.78	63.53
	21	O	O5	PLPI35	1	1
	29.04	37.48	64.91
	22	P	P5	PLPI35	1	1
	28.31	38.73	65.67
	23	O	OP52	PLPI35	1	1
	28.92	39.79	66.58
	24	H	HP52	PLPI35	1	1
	28.89	39.12	67.31
	25	O	OP53	PLPI35	1	1
	27.72	39.71	64.63
	26	O	OP54	PLPI35	1	1
	27.75	38.29	67.02
	27	C	C16	PLPI35	1	1
	30	36.85	62.72
	28	H	H6	PLPI35	1	1
	30.12	35.8	63.07
	29	O	O6	PLPI35	1	1
	28.79	36.92	61.92
	30	H	HO6	PLPI35	1	1
	28.12	36.42	62.4
	31	C	C11	PLPI35	1	1
	31.16	37.38	61.87
	32	H	H1	PLPI35	1	1
	30.96	38.47	61.8
	33	P	P	PLPI35	1	1
	31.65	37.79	59.3
	34	O	O13	PLPI35	1	1
	33.08	38.19	59.38
	35	O	O14	PLPI35	1	1
	30.58	38.8	59.17
	36	O	O12	PLPI35	1	1
	31.26	36.78	60.56
	37	O	O11	PLPI35	1	1
	31.47	36.73	58.15
	38	C	C1	PLPI35	1	1
	31.85	35.35	58.27
	39	H	HA	PLPI35	1	1
	31.12	34.78	58.89
	40	H	HB	PLPI35	1	1
	32.86	35.24	58.7
	41	C	C2	PLPI35	1	1
	31.8	34.74	56.86
	42	H	HS	PLPI35	1	1
	31.74	33.62	56.94
	43	O	O21	PLPI35	1	1
	32.92	35.14	56.06
	44	C	C21	PLPI35	1	1
	34.15	34.79	56.37
	45	O	O22	PLPI35	1	1
	34.48	33.91	57.13
	46	C	C22	PLPI35	1	1
	35.08	35.72	55.59
	47	H	H2R	PLPI35	1	1
	34.72	35.74	54.54
	48	H	H2S	PLPI35	1	1
	36.11	35.31	55.59
	49	C	C3	PLPI35	1	1
	30.5	35.3	56.23
	50	H	HX	PLPI35	1	1
	29.68	35.31	56.97
	51	H	HY	PLPI35	1	1
	30.63	36.36	55.92
	52	O	O31	PLPI35	1	1
	30.07	34.5	55.15
	53	C	C31	PLPI35	1	1
	30.74	34.75	54.06
	54	O	O32	PLPI35	1	1
	31.44	35.69	53.8
	55	C	C32	PLPI35	1	1
	30.41	33.7	53.1
	56	H	H2X	PLPI35	1	1
	30.17	34.22	52.13
	57	H	H2Y	PLPI35	1	1
	29.5	33.2	53.53
	58	C	C23	PLPI35	1	1
	35.09	37.16	56.14
	59	H	H3R	PLPI35	1	1
	36.13	37.4	56.45
	60	H	H3S	PLPI35	1	1
	34.44	37.29	57.03
	61	C	C24	PLPI35	1	1
	34.65	38.19	55.09
	62	H	H4R	PLPI35	1	1
	35.18	37.98	54.15
	63	H	H4S	PLPI35	1	1
	34.93	39.2	55.43
	64	C	C25	PLPI35	1	1
	33.15	38.18	54.79
	65	H	H5R	PLPI35	1	1
	32.57	38.24	55.72
	66	H	H5S	PLPI35	1	1
	32.96	37.23	54.26
	67	C	C26	PLPI35	1	1
	32.67	39.32	53.9
	68	H	H6R	PLPI35	1	1
	33	40.29	54.35
	69	H	H6S	PLPI35	1	1
	31.56	39.33	53.85
	70	C	C27	PLPI35	1	1
	33.23	39.16	52.49
	71	H	H7R	PLPI35	1	1
	34.34	39.15	52.55
	72	H	H7S	PLPI35	1	1
	33.1	40.12	51.99
	73	C	C28	PLPI35	1	1
	32.68	37.95	51.63
	74	H	H8R	PLPI35	1	1
	33.02	37.02	52.1
	75	H	H8S	PLPI35	1	1
	33.26	38.12	50.7
	76	C	C29	PLPI35	1	1
	31.23	37.7	51.19
	77	H	H91	PLPI35	1	1
	30.48	37.98	51.96
	78	C	C210	PLPI35	1	1
	30.8	37.71	49.89
	79	H	H101	PLPI35	1	1
	29.69	37.84	49.83
	80	C	C211	PLPI35	1	1
	31.58	37.99	48.53
	81	H	H11R	PLPI35	1	1
	31.42	37.19	47.9
	82	H	H11S	PLPI35	1	1
	32.62	38.34	48.73
	83	C	C212	PLPI35	1	1
	31.23	38.83	47.3
	84	H	H121	PLPI35	1	1
	31.55	39.85	47.34
	85	C	C213	PLPI35	1	1
	30.99	38.87	46.03
	86	H	H131	PLPI35	1	1
	30.52	39.73	45.56
	87	C	C214	PLPI35	1	1
	30.95	37.9	45.09
	88	H	H14R	PLPI35	1	1
	30.2	37.24	45.51
	89	H	H14S	PLPI35	1	1
	32.01	37.73	45.23
	90	C	C215	PLPI35	1	1
	30.69	38.71	43.84
	91	H	H15R	PLPI35	1	1
	31.39	39.55	43.74
	92	H	H15S	PLPI35	1	1
	29.71	39.2	43.77
	93	C	C216	PLPI35	1	1
	30.81	37.66	42.83
	94	H	H16R	PLPI35	1	1
	30.05	36.9	43.15
	95	H	H16S	PLPI35	1	1
	31.83	37.24	42.97
	96	C	C217	PLPI35	1	1
	30.54	38.23	41.47
	97	H	H17R	PLPI35	1	1
	31.46	38.76	41.13
	98	H	H17S	PLPI35	1	1
	29.73	39	41.55
	99	C	C218	PLPI35	1	1
	30.13	37.19	40.45
	100	H	H18R	PLPI35	1	1
	29.99	37.73	39.49
	101	H	H18S	PLPI35	1	1
	30.92	36.42	40.33
	102	H	H18T	PLPI35	1	1
	29.18	36.67	40.72
	103	C	C33	PLPI35	1	1
	31.5	32.66	52.86
	104	H	H3X	PLPI35	1	1
	31.85	32.26	53.83
	105	H	H3Y	PLPI35	1	1
	32.34	33.13	52.3
	106	C	C34	PLPI35	1	1
	30.94	31.53	52.04
	107	H	H4X	PLPI35	1	1
	29.94	31.29	52.43
	108	H	H4Y	PLPI35	1	1
	31.44	30.55	52
	109	C	C35	PLPI35	1	1
	30.82	31.83	50.6
	110	H	H5X	PLPI35	1	1
	30.26	32.73	50.34
	111	H	H5Y	PLPI35	1	1
	30.35	30.91	50.21
	112	C	C36	PLPI35	1	1
	31.95	31.95	49.77
	113	H	H6X	PLPI35	1	1
	32.28	30.87	49.81
	114	H	H6Y	PLPI35	1	1
	32.75	32.65	50.12
	115	C	C37	PLPI35	1	1
	31.46	32.27	48.37
	116	H	H7X	PLPI35	1	1
	30.81	31.54	47.84
	117	H	H7Y	PLPI35	1	1
	32.39	32.04	48
	118	C	C38	PLPI35	1	1
	31.24	33.7	47.89
	119	H	H8X	PLPI35	1	1
	30.25	33.94	48.33
	120	H	H8Y	PLPI35	1	1
	31.14	33.69	46.78
	121	C	C39	PLPI35	1	1
	32.27	34.79	48.24
	122	H	H9X	PLPI35	1	1
	32.24	35.07	49.31
	123	H	H9Y	PLPI35	1	1
	31.9	35.6	47.62
	124	C	C310	PLPI35	1	1
	33.72	34.71	47.75
	125	H	H10X	PLPI35	1	1
	33.77	34.48	46.66
	126	H	H10Y	PLPI35	1	1
	34.2	33.92	48.36
	127	C	C311	PLPI35	1	1
	34.5	36	47.88
	128	H	H11X	PLPI35	1	1
	35.59	35.77	47.94
	129	H	H11Y	PLPI35	1	1
	34.17	36.56	48.78
	130	C	C312	PLPI35	1	1
	34.29	36.84	46.63
	131	H	H12X	PLPI35	1	1
	33.25	37.19	46.65
	132	H	H12Y	PLPI35	1	1
	34.38	36.2	45.72
	133	C	C313	PLPI35	1	1
	35.29	38	46.55
	134	H	H13X	PLPI35	1	1
	36.3	37.56	46.32
	135	H	H13Y	PLPI35	1	1
	35.37	38.56	47.51
	136	C	C314	PLPI35	1	1
	34.85	39.16	45.62
	137	H	H14X	PLPI35	1	1
	35.79	39.76	45.48
	138	H	H14Y	PLPI35	1	1
	34.07	39.78	46.01
	139	C	C315	PLPI35	1	1
	34.07	38.73	44.37
	140	H	H15X	PLPI35	1	1
	33.59	37.75	44.36
	141	H	H15Y	PLPI35	1	1
	35.08	38.17	44.31
	142	C	C316	PLPI35	1	1
	33.53	39.77	43.14
	143	H	H16X	PLPI35	1	1
	34.22	40.61	42.96
	144	H	H16Y	PLPI35	1	1
	33.65	39.46	42.04
	145	H	H16Z	PLPI35	1	1
	32.99	40.68	43.26

##########
## CELL ##
##########

_cell.entry_id	PLPI35
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

