# --------------------------------------------------------------------------
#
# 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 DEPG.gro
#
#---------------------------------------------------------------------------

data_DEPG

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

_entry.id	DEPG

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

_chemical.entry_id	DEPG
_chemical.name_common	'DEPG'

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

_chemical_formula.entry_id	DEPG
_chemical_formula.structural	'C50H99O10P'

###############
## 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	C13	DEPG	1	1
	2.72	19.21	63
	2	H	H13A	DEPG	1	1
	1.69	19.52	62.73
	3	H	H13B	DEPG	1	1
	3.4	20.05	62.87
	4	O	OC3	DEPG	1	1
	2.76	18.93	64.39
	5	H	HO3	DEPG	1	1
	2.42	18.03	64.48
	6	C	C12	DEPG	1	1
	3.22	18.03	62.13
	7	H	H12A	DEPG	1	1
	2.67	17.12	62.44
	8	O	OC2	DEPG	1	1
	2.86	18.25	60.76
	9	H	HO2	DEPG	1	1
	2.58	19.18	60.72
	10	C	C11	DEPG	1	1
	4.74	17.72	62.34
	11	H	H11A	DEPG	1	1
	5.03	16.83	61.74
	12	H	H11B	DEPG	1	1
	4.84	17.44	63.41
	13	P	P	DEPG	1	1
	7.11	18.77	62.53
	14	O	O13	DEPG	1	1
	7.3	19.44	63.84
	15	O	O14	DEPG	1	1
	7.69	17.39	62.43
	16	O	O12	DEPG	1	1
	5.6	18.84	62.08
	17	O	O11	DEPG	1	1
	7.87	19.63	61.44
	18	C	C1	DEPG	1	1
	7.49	21	61.27
	19	H	HA	DEPG	1	1
	8.37	21.65	61.46
	20	H	HB	DEPG	1	1
	6.76	21.34	62.03
	21	C	C2	DEPG	1	1
	6.96	21.28	59.84
	22	H	HS	DEPG	1	1
	6.45	22.28	59.87
	23	O	O21	DEPG	1	1
	6.03	20.24	59.43
	24	C	C21	DEPG	1	1
	5.33	20.6	58.35
	25	O	O22	DEPG	1	1
	5.37	21.71	57.85
	26	C	C22	DEPG	1	1
	4.51	19.4	57.86
	27	H	H2R	DEPG	1	1
	3.5	19.43	58.32
	28	H	H2S	DEPG	1	1
	5.03	18.47	58.15
	29	C	C3	DEPG	1	1
	8.17	21.4	58.87
	30	H	HX	DEPG	1	1
	8.77	22.26	59.26
	31	H	HY	DEPG	1	1
	7.84	21.7	57.85
	32	O	O31	DEPG	1	1
	9.04	20.25	58.88
	33	C	C31	DEPG	1	1
	8.86	19.4	57.88
	34	O	O32	DEPG	1	1
	7.99	19.48	57.03
	35	C	C32	DEPG	1	1
	9.87	18.27	58.05
	36	H	H2X	DEPG	1	1
	9.53	17.69	58.93
	37	H	H2Y	DEPG	1	1
	10.86	18.72	58.3
	38	C	C23	DEPG	1	1
	4.39	19.43	56.33
	39	H	H3R	DEPG	1	1
	5.36	19.75	55.88
	40	H	H3S	DEPG	1	1
	3.62	20.17	56.06
	41	C	C24	DEPG	1	1
	3.99	18.08	55.73
	42	H	H4R	DEPG	1	1
	3.01	17.78	56.15
	43	H	H4S	DEPG	1	1
	4.74	17.31	56.02
	44	C	C25	DEPG	1	1
	3.9	18.14	54.2
	45	H	H5R	DEPG	1	1
	3.2	18.96	53.91
	46	H	H5S	DEPG	1	1
	3.47	17.19	53.82
	47	C	C26	DEPG	1	1
	5.24	18.39	53.51
	48	H	H6R	DEPG	1	1
	5.95	17.59	53.79
	49	H	H6S	DEPG	1	1
	5.68	19.36	53.84
	50	C	C27	DEPG	1	1
	5.07	18.46	51.99
	51	H	H7R	DEPG	1	1
	4.2	19.1	51.73
	52	H	H7S	DEPG	1	1
	4.85	17.45	51.61
	53	C	C28	DEPG	1	1
	6.27	19.04	51.26
	54	H	H8R	DEPG	1	1
	6.51	20.05	51.64
	55	H	H8S	DEPG	1	1
	6.05	19.11	50.17
	56	C	C29	DEPG	1	1
	7.51	18.21	51.39
	57	H	H9R	DEPG	1	1
	7.94	18.21	52.42
	58	H	H9S	DEPG	1	1
	8.22	18.67	50.68
	59	C	C210	DEPG	1	1
	7.36	16.79	50.95
	60	H	H10R	DEPG	1	1
	6.93	16.67	49.94
	61	H	H10S	DEPG	1	1
	6.71	16.25	51.68
	62	C	C211	DEPG	1	1
	8.75	16.22	50.98
	63	H	H11R	DEPG	1	1
	8.56	15.14	50.88
	64	H	H11S	DEPG	1	1
	9.19	16.36	51.99
	65	C	C212	DEPG	1	1
	9.75	16.8	49.92
	66	H	H12R	DEPG	1	1
	10.78	16.66	50.31
	67	H	H12S	DEPG	1	1
	9.65	17.85	49.73
	68	C	C213	DEPG	1	1
	9.82	16.27	48.55
	69	H	H13R	DEPG	1	1
	10.59	15.54	48.36
	70	C	C214	DEPG	1	1
	9.24	16.71	47.5
	71	H	H14R	DEPG	1	1
	9.22	16.03	46.63
	72	C	C215	DEPG	1	1
	8.34	17.9	47.49
	73	H	H15R	DEPG	1	1
	8.34	18.45	48.43
	74	H	H15S	DEPG	1	1
	7.27	17.69	47.26
	75	C	C216	DEPG	1	1
	9.01	18.67	46.4
	76	H	H16R	DEPG	1	1
	10.1	18.75	46.54
	77	H	H16S	DEPG	1	1
	8.59	19.69	46.39
	78	C	C217	DEPG	1	1
	8.7	18.06	45.07
	79	H	H17R	DEPG	1	1
	9.15	17.08	44.78
	80	H	H17S	DEPG	1	1
	8.98	18.75	44.34
	81	C	C218	DEPG	1	1
	7.33	18.39	44.69
	82	H	H18R	DEPG	1	1
	7.06	19.42	45.02
	83	H	H18S	DEPG	1	1
	6.64	17.8	45.31
	84	C	C219	DEPG	1	1
	7.26	18.35	43.14
	85	H	H19R	DEPG	1	1
	7.55	19.35	42.74
	86	H	H19S	DEPG	1	1
	6.21	18.44	43.39
	87	C	C220	DEPG	1	1
	7.86	17.1	42.24
	88	H	H20R	DEPG	1	1
	7.81	16.21	42.82
	89	H	H20S	DEPG	1	1
	8.9	17.37	42.36
	90	C	C221	DEPG	1	1
	7.39	16.58	40.66
	91	H	H21R	DEPG	1	1
	7.03	17.49	40.3
	92	H	H21S	DEPG	1	1
	6.37	16.37	40.37
	93	C	C222	DEPG	1	1
	8	15.64	39.55
	94	H	H22R	DEPG	1	1
	8.87	16.05	39.05
	95	H	H22S	DEPG	1	1
	8.22	14.63	39.89
	96	H	H22T	DEPG	1	1
	7.55	15.68	38.54
	97	C	C33	DEPG	1	1
	10.02	17.37	56.81
	98	H	H3X	DEPG	1	1
	10.89	16.68	56.98
	99	H	H3Y	DEPG	1	1
	10.3	17.99	55.94
	100	C	C34	DEPG	1	1
	8.75	16.56	56.52
	101	H	H4X	DEPG	1	1
	7.89	17.21	56.28
	102	H	H4Y	DEPG	1	1
	8.51	15.95	57.41
	103	C	C35	DEPG	1	1
	8.92	15.54	55.4
	104	H	H5X	DEPG	1	1
	9.82	15.02	55.74
	105	H	H5Y	DEPG	1	1
	9.1	16	54.41
	106	C	C36	DEPG	1	1
	7.91	14.39	55.37
	107	H	H6X	DEPG	1	1
	7.93	13.88	56.35
	108	H	H6Y	DEPG	1	1
	8.29	13.67	54.61
	109	C	C37	DEPG	1	1
	6.48	14.85	55.07
	110	H	H7X	DEPG	1	1
	6.53	15.45	54.14
	111	H	H7Y	DEPG	1	1
	6.12	15.54	55.85
	112	C	C38	DEPG	1	1
	5.46	13.71	54.97
	113	H	H8X	DEPG	1	1
	4.41	14.08	54.88
	114	H	H8Y	DEPG	1	1
	5.55	12.98	55.8
	115	C	C39	DEPG	1	1
	5.71	12.99	53.69
	116	H	H9X	DEPG	1	1
	5.06	12.11	53.52
	117	H	H9Y	DEPG	1	1
	6.76	12.62	53.8
	118	C	C310	DEPG	1	1
	5.76	13.91	52.47
	119	H	H10X	DEPG	1	1
	5.45	13.21	51.68
	120	H	H10Y	DEPG	1	1
	6.76	14.33	52.27
	121	C	C311	DEPG	1	1
	4.6	14.67	51.98
	122	H	H11X	DEPG	1	1
	4.53	15.62	52.52
	123	H	H11Y	DEPG	1	1
	3.81	13.94	52.3
	124	C	C312	DEPG	1	1
	4.58	14.88	50.43
	125	H	H12X	DEPG	1	1
	4.4	13.87	49.96
	126	H	H12Y	DEPG	1	1
	5.55	15.17	50.02
	127	C	C313	DEPG	1	1
	3.65	15.98	49.95
	128	H	H13X	DEPG	1	1
	2.89	16.33	50.63
	129	C	C314	DEPG	1	1
	3.38	16.33	48.7
	130	H	H14X	DEPG	1	1
	2.41	16.79	48.48
	131	C	C315	DEPG	1	1
	3.97	15.71	47.54
	132	H	H15X	DEPG	1	1
	3.72	14.72	47.17
	133	H	H15Y	DEPG	1	1
	4.87	15.38	47.95
	134	C	C316	DEPG	1	1
	4	16.8	46.52
	135	H	H16X	DEPG	1	1
	4.51	16.29	45.74
	136	H	H16Y	DEPG	1	1
	4.64	17.62	46.91
	137	C	C317	DEPG	1	1
	2.73	17.26	45.8
	138	H	H17X	DEPG	1	1
	3.04	18.2	45.3
	139	H	H17Y	DEPG	1	1
	1.92	17.45	46.53
	140	C	C318	DEPG	1	1
	2.18	16.32	44.69
	141	H	H18X	DEPG	1	1
	1.21	15.98	45.09
	142	H	H18Y	DEPG	1	1
	2.85	15.45	44.54
	143	C	C319	DEPG	1	1
	1.69	16.94	43.37
	144	H	H19X	DEPG	1	1
	1.89	18.03	43.42
	145	H	H19Y	DEPG	1	1
	0.6	16.74	43.28
	146	C	C320	DEPG	1	1
	2.16	16.35	42.05
	147	H	H20X	DEPG	1	1
	3.15	16.18	42.28
	148	H	H20Y	DEPG	1	1
	2.21	17.08	41.23
	149	C	C321	DEPG	1	1
	1.94	14.87	41.71
	150	H	H21X	DEPG	1	1
	0.93	14.51	41.78
	151	H	H21Y	DEPG	1	1
	2.54	14.24	42.41
	152	C	C322	DEPG	1	1
	2.46	14.59	40.33
	153	H	H22X	DEPG	1	1
	3.34	15.23	40.39
	154	H	H22Y	DEPG	1	1
	2.64	13.51	40.15
	155	H	H22Z	DEPG	1	1
	2.24	15.08	39.39

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

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

