# --------------------------------------------------------------------------
#
# 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 PLPI24.gro
#
#---------------------------------------------------------------------------

data_PLPI24

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

_entry.id	PLPI24

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

_chemical.entry_id	PLPI24
_chemical.name_common	'PLPI24'

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

_chemical_formula.entry_id	PLPI24
_chemical_formula.structural	'C43H81O19P3'

###############
## 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	PLPI24	1	1
	49.26	39.01	62.57
	2	H	H2	PLPI24	1	1
	49.63	39.85	61.92
	3	O	O2	PLPI24	1	1
	50.28	38.01	62.68
	4	H	HO2	PLPI24	1	1
	51.12	38.42	62.49
	5	C	C13	PLPI24	1	1
	48.91	39.59	63.93
	6	H	H3	PLPI24	1	1
	48.15	40.39	63.76
	7	O	O3	PLPI24	1	1
	50.05	40.23	64.53
	8	H	HO3	PLPI24	1	1
	49.73	40.69	65.31
	9	C	C14	PLPI24	1	1
	48.31	38.52	64.84
	10	H	H4	PLPI24	1	1
	49.08	37.74	65.06
	11	O	O4	PLPI24	1	1
	47.89	39.23	66.02
	12	P	P4	PLPI24	1	1
	48.1	38.61	67.53
	13	O	OP42	PLPI24	1	1
	49.67	38.85	67.75
	14	H	HP42	PLPI24	1	1
	50.16	38.14	67.33
	15	O	OP43	PLPI24	1	1
	47.38	39.54	68.52
	16	O	OP44	PLPI24	1	1
	47.94	37.1	67.66
	17	C	C15	PLPI24	1	1
	47.09	37.91	64.14
	18	H	H5	PLPI24	1	1
	46.36	38.74	63.99
	19	O	O5	PLPI24	1	1
	46.55	36.89	64.98
	20	P	P5	PLPI24	1	1
	44.96	36.98	65.44
	21	O	OP52	PLPI24	1	1
	44.21	36.83	64.14
	22	O	OP53	PLPI24	1	1
	44.92	35.78	66.38
	23	O	OP54	PLPI24	1	1
	44.78	38.35	66.1
	24	C	C16	PLPI24	1	1
	47.44	37.33	62.75
	25	H	H6	PLPI24	1	1
	48.21	36.54	62.82
	26	O	O6	PLPI24	1	1
	46.33	36.75	62.04
	27	H	HO6	PLPI24	1	1
	46.46	35.81	62.07
	28	C	C11	PLPI24	1	1
	48	38.46	61.91
	29	H	H1	PLPI24	1	1
	47.21	39.26	61.95
	30	P	P	PLPI24	1	1
	47.94	39.04	59.3
	31	O	O13	PLPI24	1	1
	49.12	39.92	59.25
	32	O	O14	PLPI24	1	1
	46.56	39.59	59.35
	33	O	O12	PLPI24	1	1
	48.21	38	60.57
	34	O	O11	PLPI24	1	1
	48.11	38.05	58.1
	35	C	C1	PLPI24	1	1
	47.48	36.79	58.16
	36	H	HA	PLPI24	1	1
	46.65	36.74	58.91
	37	H	HB	PLPI24	1	1
	48.27	36.09	58.48
	38	C	C2	PLPI24	1	1
	46.9	36.35	56.78
	39	H	HS	PLPI24	1	1
	46.66	35.26	56.83
	40	O	O21	PLPI24	1	1
	47.79	36.69	55.71
	41	C	C21	PLPI24	1	1
	48.8	35.88	55.57
	42	O	O22	PLPI24	1	1
	48.9	34.77	56.07
	43	C	C22	PLPI24	1	1
	49.87	36.55	54.68
	44	H	H2R	PLPI24	1	1
	50.75	36.76	55.32
	45	H	H2S	PLPI24	1	1
	49.47	37.52	54.32
	46	C	C3	PLPI24	1	1
	45.58	37.05	56.43
	47	H	HX	PLPI24	1	1
	45.22	36.56	55.49
	48	H	HY	PLPI24	1	1
	44.82	36.95	57.23
	49	O	O31	PLPI24	1	1
	45.8	38.44	56.25
	50	C	C31	PLPI24	1	1
	44.89	39.04	55.54
	51	O	O32	PLPI24	1	1
	43.88	38.58	55.05
	52	C	C32	PLPI24	1	1
	45.32	40.39	55.37
	53	H	H2X	PLPI24	1	1
	45.34	40.83	56.39
	54	H	H2Y	PLPI24	1	1
	44.6	40.95	54.74
	55	C	C23	PLPI24	1	1
	50.36	35.61	53.57
	56	H	H3R	PLPI24	1	1
	50.88	34.78	54.11
	57	H	H3S	PLPI24	1	1
	51.13	36.09	52.93
	58	C	C24	PLPI24	1	1
	49.27	34.92	52.73
	59	H	H4R	PLPI24	1	1
	48.54	34.45	53.43
	60	H	H4S	PLPI24	1	1
	49.78	34.09	52.19
	61	C	C25	PLPI24	1	1
	48.51	35.77	51.7
	62	H	H5R	PLPI24	1	1
	49.25	36.06	50.91
	63	H	H5S	PLPI24	1	1
	48.09	36.71	52.1
	64	C	C26	PLPI24	1	1
	47.37	34.97	51.06
	65	H	H6R	PLPI24	1	1
	47.61	33.9	51.26
	66	H	H6S	PLPI24	1	1
	47.38	35.15	49.96
	67	C	C27	PLPI24	1	1
	45.91	35.2	51.5
	68	H	H7R	PLPI24	1	1
	45.77	34.78	52.52
	69	H	H7S	PLPI24	1	1
	45.27	34.62	50.79
	70	C	C28	PLPI24	1	1
	45.48	36.69	51.45
	71	H	H8R	PLPI24	1	1
	45.62	37.05	50.41
	72	H	H8S	PLPI24	1	1
	46.11	37.25	52.14
	73	C	C29	PLPI24	1	1
	44.16	37.15	51.94
	74	H	H91	PLPI24	1	1
	44.05	37.05	53.02
	75	C	C210	PLPI24	1	1
	43.07	37.39	51.23
	76	H	H101	PLPI24	1	1
	42.12	37.41	51.78
	77	C	C211	PLPI24	1	1
	43.01	37.2	49.75
	78	H	H11R	PLPI24	1	1
	41.99	37.03	49.37
	79	H	H11S	PLPI24	1	1
	43.6	36.3	49.46
	80	C	C212	PLPI24	1	1
	43.36	38.4	49.04
	81	H	H121	PLPI24	1	1
	42.84	39.27	49.46
	82	C	C213	PLPI24	1	1
	44.21	38.4	48.03
	83	H	H131	PLPI24	1	1
	44.49	39.39	47.68
	84	C	C214	PLPI24	1	1
	44.93	37.18	47.46
	85	H	H14R	PLPI24	1	1
	44.36	36.23	47.57
	86	H	H14S	PLPI24	1	1
	45.86	37	48.04
	87	C	C215	PLPI24	1	1
	45.31	37.25	45.96
	88	H	H15R	PLPI24	1	1
	45.8	36.29	45.68
	89	H	H15S	PLPI24	1	1
	46.04	38.06	45.78
	90	C	C216	PLPI24	1	1
	44.11	37.49	45.04
	91	H	H16R	PLPI24	1	1
	43.66	38.49	45.1
	92	H	H16S	PLPI24	1	1
	43.36	36.81	45.46
	93	C	C217	PLPI24	1	1
	44.39	37.17	43.56
	94	H	H17R	PLPI24	1	1
	44.49	36.05	43.62
	95	H	H17S	PLPI24	1	1
	45.37	37.45	43.18
	96	C	C218	PLPI24	1	1
	43.51	37.94	42.5
	97	H	H18R	PLPI24	1	1
	43.61	37.59	41.46
	98	H	H18S	PLPI24	1	1
	42.53	37.58	42.14
	99	H	H18T	PLPI24	1	1
	42.83	38.66	42.99
	100	C	C33	PLPI24	1	1
	46.65	40.18	54.66
	101	H	H3X	PLPI24	1	1
	47.47	39.68	55.19
	102	H	H3Y	PLPI24	1	1
	47.31	40.9	55.03
	103	C	C34	PLPI24	1	1
	46.51	40.14	53.09
	104	H	H4X	PLPI24	1	1
	46.16	39.12	52.99
	105	H	H4Y	PLPI24	1	1
	47.48	40.1	52.57
	106	C	C35	PLPI24	1	1
	45.62	41.14	52.2
	107	H	H5X	PLPI24	1	1
	45.87	42.24	52.09
	108	H	H5Y	PLPI24	1	1
	44.6	41.16	52.61
	109	C	C36	PLPI24	1	1
	45.67	40.72	50.73
	110	H	H6X	PLPI24	1	1
	44.76	41.14	50.27
	111	H	H6Y	PLPI24	1	1
	45.67	39.62	50.87
	112	C	C37	PLPI24	1	1
	46.89	41.1	49.85
	113	H	H7X	PLPI24	1	1
	47.79	40.57	50.26
	114	H	H7Y	PLPI24	1	1
	47.04	42.2	49.91
	115	C	C38	PLPI24	1	1
	46.84	40.66	48.42
	116	H	H8X	PLPI24	1	1
	46.07	41.27	47.9
	117	H	H8Y	PLPI24	1	1
	46.51	39.6	48.56
	118	C	C39	PLPI24	1	1
	48.18	40.71	47.67
	119	H	H9X	PLPI24	1	1
	49	40.25	48.27
	120	H	H9Y	PLPI24	1	1
	48.43	41.78	47.47
	121	C	C310	PLPI24	1	1
	48.15	39.95	46.35
	122	H	H10X	PLPI24	1	1
	47.75	38.95	46.61
	123	H	H10Y	PLPI24	1	1
	49.16	39.79	45.91
	124	C	C311	PLPI24	1	1
	47.27	40.69	45.35
	125	H	H11X	PLPI24	1	1
	47.59	41.75	45.29
	126	H	H11Y	PLPI24	1	1
	46.22	40.65	45.71
	127	C	C312	PLPI24	1	1
	47.3	40.02	43.98
	128	H	H12X	PLPI24	1	1
	46.78	39.05	44.09
	129	H	H12Y	PLPI24	1	1
	48.34	39.84	43.63
	130	C	C313	PLPI24	1	1
	46.55	40.8	42.91
	131	H	H13X	PLPI24	1	1
	46.96	41.84	42.85
	132	H	H13Y	PLPI24	1	1
	45.47	40.88	43.17
	133	C	C314	PLPI24	1	1
	46.66	40.11	41.54
	134	H	H14X	PLPI24	1	1
	45.97	40.77	40.97
	135	H	H14Y	PLPI24	1	1
	46.31	39.07	41.56
	136	C	C315	PLPI24	1	1
	48.09	40.06	40.96
	137	H	H15X	PLPI24	1	1
	48.76	39.38	41.52
	138	H	H15Y	PLPI24	1	1
	48.32	41.07	41.18
	139	C	C316	PLPI24	1	1
	48.38	39.95	39.48
	140	H	H16X	PLPI24	1	1
	47.65	40.63	38.97
	141	H	H16Y	PLPI24	1	1
	49.35	40.3	39.08
	142	H	H16Z	PLPI24	1	1
	48.26	38.87	39.22

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

_cell.entry_id	PLPI24
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

