# --------------------------------------------------------------------------
#
# 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 PLPI2C.gro
#
#---------------------------------------------------------------------------

data_PLPI2C

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

_entry.id	PLPI2C

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

_chemical.entry_id	PLPI2C
_chemical.name_common	'PLPI2C'

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

_chemical_formula.entry_id	PLPI2C
_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	PLPI2C	1	1
	-0.86	51.84	62.33
	2	H	H2	PLPI2C	1	1
	-1.61	51.19	61.82
	3	O	O2	PLPI2C	1	1
	-1.37	53.15	62.44
	4	H	HO2	PLPI2C	1	1
	-1.69	53.43	61.57
	5	C	C13	PLPI2C	1	1
	-0.32	51.21	63.63
	6	H	H3	PLPI2C	1	1
	0.24	50.31	63.22
	7	O	O3	PLPI2C	1	1
	-1.43	50.92	64.42
	8	P	P3	PLPI2C	1	1
	-1.08	49.49	65.04
	9	O	OP32	PLPI2C	1	1
	-1.7	49.83	66.36
	10	H	HP32	PLPI2C	1	1
	-1.06	50.58	66.47
	11	O	OP33	PLPI2C	1	1
	-1.98	48.65	64.19
	12	O	OP34	PLPI2C	1	1
	0.42	49.36	65.14
	13	C	C14	PLPI2C	1	1
	0.79	52.03	64.33
	14	H	H4	PLPI2C	1	1
	0.08	52.85	64.48
	15	O	O4	PLPI2C	1	1
	1.46	51.8	65.59
	16	P	P4	PLPI2C	1	1
	1.8	53.02	66.67
	17	O	OP42	PLPI2C	1	1
	3.16	53.59	66.86
	18	O	OP43	PLPI2C	1	1
	0.64	54.01	66.82
	19	O	OP44	PLPI2C	1	1
	1.63	52.08	67.78
	20	C	C15	PLPI2C	1	1
	1.88	51.93	63.36
	21	H	H5	PLPI2C	1	1
	2.36	50.94	63.35
	22	O	O5	PLPI2C	1	1
	2.92	52.74	63.83
	23	H	HO5	PLPI2C	1	1
	3.41	52.36	64.58
	24	C	C16	PLPI2C	1	1
	1.36	52.4	62.01
	25	H	H6	PLPI2C	1	1
	0.97	53.45	62.21
	26	O	O6	PLPI2C	1	1
	2.31	51.99	60.95
	27	H	HO6	PLPI2C	1	1
	2.17	52.56	60.14
	28	C	C11	PLPI2C	1	1
	0.24	51.79	61.46
	29	H	H1	PLPI2C	1	1
	0.53	50.79	61.56
	30	P	P	PLPI2C	1	1
	-0.04	51.47	58.81
	31	O	O13	PLPI2C	1	1
	-0.83	50.26	58.96
	32	O	O14	PLPI2C	1	1
	1.41	51.36	58.69
	33	O	O12	PLPI2C	1	1
	-0.17	52.29	60.17
	34	O	O11	PLPI2C	1	1
	-0.46	52.36	57.67
	35	C	C1	PLPI2C	1	1
	-1.46	53.31	57.93
	36	H	HA	PLPI2C	1	1
	-1.83	53.34	58.98
	37	H	HB	PLPI2C	1	1
	-2.27	52.98	57.29
	38	C	C2	PLPI2C	1	1
	-1.06	54.7	57.45
	39	H	HS	PLPI2C	1	1
	-1.84	55.4	57.63
	40	O	O21	PLPI2C	1	1
	-0.67	54.63	56.08
	41	C	C21	PLPI2C	1	1
	-0.74	55.75	55.41
	42	O	O22	PLPI2C	1	1
	-1.06	56.84	55.86
	43	C	C22	PLPI2C	1	1
	-0.51	55.43	53.93
	44	H	H2R	PLPI2C	1	1
	0.58	55.37	53.77
	45	H	H2S	PLPI2C	1	1
	-0.92	56.27	53.33
	46	C	C3	PLPI2C	1	1
	0	55.31	58.24
	47	H	HX	PLPI2C	1	1
	-0.02	56.42	58.03
	48	H	HY	PLPI2C	1	1
	-0.3	55.34	59.32
	49	O	O31	PLPI2C	1	1
	1.15	54.41	57.91
	50	C	C31	PLPI2C	1	1
	2.2	55.12	57.91
	51	O	O32	PLPI2C	1	1
	2.03	56.31	58.1
	52	C	C32	PLPI2C	1	1
	3.6	54.25	57.7
	53	H	H2X	PLPI2C	1	1
	3.25	53.25	58
	54	H	H2Y	PLPI2C	1	1
	4.36	54.6	58.44
	55	C	C23	PLPI2C	1	1
	-1.14	54.09	53.42
	56	H	H3R	PLPI2C	1	1
	-2.21	54.02	53.72
	57	H	H3S	PLPI2C	1	1
	-0.61	53.24	53.91
	58	C	C24	PLPI2C	1	1
	-1	54.01	51.89
	59	H	H4R	PLPI2C	1	1
	0.06	54.23	51.64
	60	H	H4S	PLPI2C	1	1
	-1.62	54.82	51.46
	61	C	C25	PLPI2C	1	1
	-1.33	52.65	51.22
	62	H	H5R	PLPI2C	1	1
	-2.42	52.45	51.29
	63	H	H5S	PLPI2C	1	1
	-0.8	51.85	51.77
	64	C	C26	PLPI2C	1	1
	-0.87	52.6	49.74
	65	H	H6R	PLPI2C	1	1
	0.22	52.79	49.71
	66	H	H6S	PLPI2C	1	1
	-1.37	53.4	49.16
	67	C	C27	PLPI2C	1	1
	-1.14	51.26	49.03
	68	H	H7R	PLPI2C	1	1
	-2.23	51.03	49.08
	69	H	H7S	PLPI2C	1	1
	-0.61	50.46	49.6
	70	C	C28	PLPI2C	1	1
	-0.68	51.2	47.56
	71	H	H8R	PLPI2C	1	1
	-0.69	50.13	47.23
	72	H	H8S	PLPI2C	1	1
	0.38	51.53	47.49
	73	C	C29	PLPI2C	1	1
	-1.51	52.01	46.61
	74	H	H91	PLPI2C	1	1
	-2.36	52.56	47.04
	75	C	C210	PLPI2C	1	1
	-1.35	52.01	45.29
	76	H	H101	PLPI2C	1	1
	-2	52.65	44.66
	77	C	C211	PLPI2C	1	1
	-0.32	51.21	44.55
	78	H	H11R	PLPI2C	1	1
	-0.71	50.17	44.42
	79	H	H11S	PLPI2C	1	1
	0.65	51.1	45.09
	80	C	C212	PLPI2C	1	1
	-0.08	51.81	43.22
	81	H	H121	PLPI2C	1	1
	-0.42	52.85	43.02
	82	C	C213	PLPI2C	1	1
	0.57	51.11	42.3
	83	H	H131	PLPI2C	1	1
	0.89	51.52	41.35
	84	C	C214	PLPI2C	1	1
	1.12	49.77	42.41
	85	H	H14R	PLPI2C	1	1
	0.44	49.04	41.95
	86	H	H14S	PLPI2C	1	1
	1.27	49.55	43.48
	87	C	C215	PLPI2C	1	1
	2.43	49.82	41.65
	88	H	H15R	PLPI2C	1	1
	3.07	50.5	42.16
	89	H	H15S	PLPI2C	1	1
	2.33	49.82	40.54
	90	C	C216	PLPI2C	1	1
	3.46	48.88	42.05
	91	H	H16R	PLPI2C	1	1
	2.75	48.3	41.53
	92	H	H16S	PLPI2C	1	1
	3.51	48.76	43.16
	93	C	C217	PLPI2C	1	1
	4.63	48.38	41.33
	94	H	H17R	PLPI2C	1	1
	5.17	47.54	41.7
	95	H	H17S	PLPI2C	1	1
	5.19	49.12	41.76
	96	C	C218	PLPI2C	1	1
	4.7	48.48	39.87
	97	H	H18R	PLPI2C	1	1
	4.14	47.7	39.33
	98	H	H18S	PLPI2C	1	1
	4.19	49.38	39.73
	99	H	H18T	PLPI2C	1	1
	5.77	48.55	39.59
	100	C	C33	PLPI2C	1	1
	4.34	54.04	56.26
	101	H	H3X	PLPI2C	1	1
	5.34	53.57	56.22
	102	H	H3Y	PLPI2C	1	1
	4.91	54.94	55.85
	103	C	C34	PLPI2C	1	1
	3.26	53.75	55.18
	104	H	H4X	PLPI2C	1	1
	2.32	54.38	55.22
	105	H	H4Y	PLPI2C	1	1
	2.88	52.74	55.37
	106	C	C35	PLPI2C	1	1
	3.78	53.96	53.76
	107	H	H5X	PLPI2C	1	1
	4.84	53.64	53.79
	108	H	H5Y	PLPI2C	1	1
	3.75	55.04	53.47
	109	C	C36	PLPI2C	1	1
	3.04	53.14	52.7
	110	H	H6X	PLPI2C	1	1
	1.97	53.45	52.66
	111	H	H6Y	PLPI2C	1	1
	3.06	52.08	53.05
	112	C	C37	PLPI2C	1	1
	3.74	53.33	51.35
	113	H	H7X	PLPI2C	1	1
	4.83	53.27	51.53
	114	H	H7Y	PLPI2C	1	1
	3.52	54.37	50.99
	115	C	C38	PLPI2C	1	1
	3.41	52.31	50.25
	116	H	H8X	PLPI2C	1	1
	2.32	52.1	50.22
	117	H	H8Y	PLPI2C	1	1
	3.92	51.36	50.55
	118	C	C39	PLPI2C	1	1
	3.92	52.74	48.86
	119	H	H9X	PLPI2C	1	1
	5.03	52.68	48.87
	120	H	H9Y	PLPI2C	1	1
	3.64	53.79	48.65
	121	C	C310	PLPI2C	1	1
	3.4	51.84	47.73
	122	H	H10X	PLPI2C	1	1
	2.3	51.82	47.73
	123	H	H10Y	PLPI2C	1	1
	3.78	50.81	47.91
	124	C	C311	PLPI2C	1	1
	3.87	52.25	46.35
	125	H	H11X	PLPI2C	1	1
	3.58	51.5	45.56
	126	H	H11Y	PLPI2C	1	1
	4.98	52.33	46.33
	127	C	C312	PLPI2C	1	1
	3.3	53.58	45.9
	128	H	H12X	PLPI2C	1	1
	3.35	54.43	46.6
	129	H	H12Y	PLPI2C	1	1
	2.25	53.44	45.52
	130	C	C313	PLPI2C	1	1
	4.22	53.99	44.81
	131	H	H13X	PLPI2C	1	1
	4.36	53	44.38
	132	H	H13Y	PLPI2C	1	1
	5.25	54.35	44.92
	133	C	C314	PLPI2C	1	1
	3.51	55.03	44.07
	134	H	H14X	PLPI2C	1	1
	3.74	55.84	44.71
	135	H	H14Y	PLPI2C	1	1
	2.42	54.99	44.24
	136	C	C315	PLPI2C	1	1
	4.04	55.28	42.67
	137	H	H15X	PLPI2C	1	1
	5.15	55.32	42.64
	138	H	H15Y	PLPI2C	1	1
	3.42	56.09	42.27
	139	C	C316	PLPI2C	1	1
	4.02	54.73	41.36
	140	H	H16X	PLPI2C	1	1
	4.58	54.87	40.51
	141	H	H16Y	PLPI2C	1	1
	4.74	54.05	41.59
	142	H	H16Z	PLPI2C	1	1
	3.13	54.38	40.72

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

_cell.entry_id	PLPI2C
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

