# --------------------------------------------------------------------------
#
# 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 PLPI14.gro
#
#---------------------------------------------------------------------------

data_PLPI14

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

_entry.id	PLPI14

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

_chemical.entry_id	PLPI14
_chemical.name_common	'PLPI14'

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

_chemical_formula.entry_id	PLPI14
_chemical_formula.structural	'C43H82O16P2'

###############
## 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	PLPI14	1	1
	39.09	43.4	61.9
	2	H	H2	PLPI14	1	1
	38.8	44.15	61.07
	3	O	O2	PLPI14	1	1
	40.57	43.22	61.89
	4	H	HO2	PLPI14	1	1
	40.73	43.92	62.59
	5	C	C13	PLPI14	1	1
	38.66	43.9	63.22
	6	H	H3	PLPI14	1	1
	37.55	44.11	63.2
	7	O	O3	PLPI14	1	1
	39.41	44.98	63.04
	8	H	HO3	PLPI14	1	1
	38.74	45.64	63.37
	9	C	C14	PLPI14	1	1
	38.92	43.1	64.51
	10	H	H4	PLPI14	1	1
	40.01	42.89	64.51
	11	O	O4	PLPI14	1	1
	38.55	43.78	65.75
	12	P	P4	PLPI14	1	1
	39.68	43.94	67.02
	13	O	OP42	PLPI14	1	1
	40.41	45.23	66.79
	14	O	OP43	PLPI14	1	1
	40.56	42.66	67.05
	15	O	OP44	PLPI14	1	1
	38.94	44.16	68.35
	16	C	C15	PLPI14	1	1
	38.09	41.88	64.28
	17	H	H5	PLPI14	1	1
	37.01	42.17	64.31
	18	O	O5	PLPI14	1	1
	38.31	40.93	65.32
	19	H	HO5	PLPI14	1	1
	37.52	40.38	65.36
	20	C	C16	PLPI14	1	1
	38.51	41.29	62.92
	21	H	H6	PLPI14	1	1
	39.59	41.07	62.97
	22	O	O6	PLPI14	1	1
	37.85	40.1	62.58
	23	H	HO6	PLPI14	1	1
	38.32	39.37	62.97
	24	C	C11	PLPI14	1	1
	38.28	42.22	61.76
	25	H	H1	PLPI14	1	1
	37.2	42.59	61.79
	26	P	P	PLPI14	1	1
	37.56	41.72	59.3
	27	O	O13	PLPI14	1	1
	37.28	43.1	58.89
	28	O	O14	PLPI14	1	1
	36.47	40.8	59.66
	29	O	O12	PLPI14	1	1
	38.68	41.71	60.49
	30	O	O11	PLPI14	1	1
	38.47	41.07	58.21
	31	C	C1	PLPI14	1	1
	39.71	41.7	57.88
	32	H	HA	PLPI14	1	1
	40.44	41.52	58.68
	33	H	HB	PLPI14	1	1
	39.59	42.8	57.77
	34	C	C2	PLPI14	1	1
	40.28	41.06	56.58
	35	H	HS	PLPI14	1	1
	41.31	41.44	56.4
	36	O	O21	PLPI14	1	1
	39.44	41.36	55.48
	37	C	C21	PLPI14	1	1
	39.34	42.6	55.15
	38	O	O22	PLPI14	1	1
	39.96	43.55	55.61
	39	C	C22	PLPI14	1	1
	38.38	42.64	53.96
	40	H	H2R	PLPI14	1	1
	37.4	42.9	54.41
	41	H	H2S	PLPI14	1	1
	38.3	41.65	53.5
	42	C	C3	PLPI14	1	1
	40.38	39.51	56.72
	43	H	HX	PLPI14	1	1
	41.38	39.28	57.14
	44	H	HY	PLPI14	1	1
	39.59	39.18	57.44
	45	O	O31	PLPI14	1	1
	40.28	38.83	55.46
	46	C	C31	PLPI14	1	1
	39.46	37.79	55.35
	47	O	O32	PLPI14	1	1
	38.64	37.42	56.18
	48	C	C32	PLPI14	1	1
	39.72	37.17	53.99
	49	H	H2X	PLPI14	1	1
	40.18	36.19	54.19
	50	H	H2Y	PLPI14	1	1
	40.4	37.8	53.39
	51	C	C23	PLPI14	1	1
	38.93	43.63	52.91
	52	H	H3R	PLPI14	1	1
	39.96	43.37	52.62
	53	H	H3S	PLPI14	1	1
	38.94	44.58	53.5
	54	C	C24	PLPI14	1	1
	38.33	43.74	51.49
	55	H	H4R	PLPI14	1	1
	38.8	44.37	50.74
	56	H	H4S	PLPI14	1	1
	37.63	44.49	51.6
	57	C	C25	PLPI14	1	1
	37.63	42.56	50.85
	58	H	H5R	PLPI14	1	1
	37.08	42.04	51.67
	59	H	H5S	PLPI14	1	1
	38.47	41.96	50.52
	60	C	C26	PLPI14	1	1
	36.78	42.78	49.58
	61	H	H6R	PLPI14	1	1
	36	43.52	49.59
	62	H	H6S	PLPI14	1	1
	36.23	41.84	49.38
	63	C	C27	PLPI14	1	1
	37.29	43.55	48.4
	64	H	H7R	PLPI14	1	1
	37.89	42.78	47.92
	65	H	H7S	PLPI14	1	1
	37.86	44.43	48.77
	66	C	C28	PLPI14	1	1
	36.19	44.12	47.48
	67	H	H8R	PLPI14	1	1
	36.71	44.8	46.78
	68	H	H8S	PLPI14	1	1
	35.48	44.83	48.01
	69	C	C29	PLPI14	1	1
	35.46	43	46.76
	70	H	H91	PLPI14	1	1
	34.76	42.37	47.33
	71	C	C210	PLPI14	1	1
	35.41	42.84	45.45
	72	H	H101	PLPI14	1	1
	34.56	42.22	45.09
	73	C	C211	PLPI14	1	1
	36.12	43.77	44.49
	74	H	H11R	PLPI14	1	1
	36.32	43.15	43.61
	75	H	H11S	PLPI14	1	1
	37.09	44.02	44.92
	76	C	C212	PLPI14	1	1
	35.65	45.12	44.03
	77	H	H121	PLPI14	1	1
	35.76	46	44.67
	78	C	C213	PLPI14	1	1
	34.78	45.2	43.05
	79	H	H131	PLPI14	1	1
	34.22	46.16	42.96
	80	C	C214	PLPI14	1	1
	34.24	43.93	42.4
	81	H	H14R	PLPI14	1	1
	33.25	43.63	42.75
	82	H	H14S	PLPI14	1	1
	34.6	42.94	42.7
	83	C	C215	PLPI14	1	1
	34.2	44.2	40.95
	84	H	H15R	PLPI14	1	1
	35.24	44.08	40.59
	85	H	H15S	PLPI14	1	1
	33.84	45.23	40.68
	86	C	C216	PLPI14	1	1
	33.3	43.25	40.23
	87	H	H16R	PLPI14	1	1
	32.28	43.1	40.65
	88	H	H16S	PLPI14	1	1
	33.77	42.24	40.14
	89	C	C217	PLPI14	1	1
	33.27	43.93	38.91
	90	H	H17R	PLPI14	1	1
	32.95	44.97	38.74
	91	H	H17S	PLPI14	1	1
	32.3	43.51	38.59
	92	C	C218	PLPI14	1	1
	34.66	43.58	38.29
	93	H	H18R	PLPI14	1	1
	34.58	43.28	37.28
	94	H	H18S	PLPI14	1	1
	35.36	44.43	38.23
	95	H	H18T	PLPI14	1	1
	35.06	42.56	38.39
	96	C	C33	PLPI14	1	1
	38.42	37	53.2
	97	H	H3X	PLPI14	1	1
	37.74	36.32	53.77
	98	H	H3Y	PLPI14	1	1
	38.67	36.53	52.22
	99	C	C34	PLPI14	1	1
	37.77	38.36	52.96
	100	H	H4X	PLPI14	1	1
	38.45	39.19	53.28
	101	H	H4Y	PLPI14	1	1
	36.93	38.44	53.66
	102	C	C35	PLPI14	1	1
	37.31	38.66	51.53
	103	H	H5X	PLPI14	1	1
	36.65	39.56	51.65
	104	H	H5Y	PLPI14	1	1
	36.66	37.87	51.11
	105	C	C36	PLPI14	1	1
	38.46	39.05	50.58
	106	H	H6X	PLPI14	1	1
	39.28	38.3	50.54
	107	H	H6Y	PLPI14	1	1
	38.92	39.99	50.97
	108	C	C37	PLPI14	1	1
	37.99	39.27	49.14
	109	H	H7X	PLPI14	1	1
	37.03	39.84	49.15
	110	H	H7Y	PLPI14	1	1
	37.77	38.29	48.67
	111	C	C38	PLPI14	1	1
	39.03	40.05	48.32
	112	H	H8X	PLPI14	1	1
	40.02	39.56	48.43
	113	H	H8Y	PLPI14	1	1
	39.11	41.08	48.73
	114	C	C39	PLPI14	1	1
	38.66	40.11	46.84
	115	H	H9X	PLPI14	1	1
	37.69	40.65	46.69
	116	H	H9Y	PLPI14	1	1
	38.51	39.05	46.53
	117	C	C310	PLPI14	1	1
	39.72	40.78	45.96
	118	H	H10X	PLPI14	1	1
	40.68	40.23	46.09
	119	H	H10Y	PLPI14	1	1
	39.87	41.84	46.25
	120	C	C311	PLPI14	1	1
	39.39	40.8	44.47
	121	H	H11X	PLPI14	1	1
	40.22	41.33	43.94
	122	H	H11Y	PLPI14	1	1
	38.52	41.47	44.34
	123	C	C312	PLPI14	1	1
	39.26	39.39	43.89
	124	H	H12X	PLPI14	1	1
	39.76	38.65	44.53
	125	H	H12Y	PLPI14	1	1
	39.67	39.38	42.86
	126	C	C313	PLPI14	1	1
	37.86	38.86	43.83
	127	H	H13X	PLPI14	1	1
	37.4	38.84	44.84
	128	H	H13Y	PLPI14	1	1
	37.74	37.84	43.42
	129	C	C314	PLPI14	1	1
	37.2	39.81	42.92
	130	H	H14X	PLPI14	1	1
	37.59	40.02	41.93
	131	H	H14Y	PLPI14	1	1
	37.05	40.82	43.45
	132	C	C315	PLPI14	1	1
	35.96	39.19	42.41
	133	H	H15X	PLPI14	1	1
	35.6	39.97	41.72
	134	H	H15Y	PLPI14	1	1
	35.72	39.69	43.38
	135	C	C316	PLPI14	1	1
	35.28	37.68	42.15
	136	H	H16X	PLPI14	1	1
	35.33	37.36	41.13
	137	H	H16Y	PLPI14	1	1
	35.26	36.85	42.92
	138	H	H16Z	PLPI14	1	1
	34.14	37.64	42.23

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

_cell.entry_id	PLPI14
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

