# --------------------------------------------------------------------------
#
# 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 TOCL2.gro
#
#---------------------------------------------------------------------------

data_TOCL2

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

_entry.id	TOCL2

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

_chemical.entry_id	TOCL2
_chemical.name_common	'TOCL2'

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

_chemical_formula.entry_id	TOCL2
_chemical_formula.structural	'C81H156O17P2'

###############
## 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	C3	TOCL2	1	1
	13.78	35.75	58.75
	2	H	HG31	TOCL2	1	1
	14.57	36.53	58.92
	3	H	HG32	TOCL2	1	1
	13.99	35.29	57.76
	4	P	P3	TOCL2	1	1
	12.15	37.7	58.18
	5	O	OP33	TOCL2	1	1
	13.02	38.64	58.95
	6	O	OP34	TOCL2	1	1
	10.67	37.93	58.26
	7	O	OP31	TOCL2	1	1
	12.46	36.29	58.8
	8	O	OP32	TOCL2	1	1
	12.63	37.53	56.69
	9	C	C31	TOCL2	1	1
	11.82	36.77	55.8
	10	H	H31J	TOCL2	1	1
	11.66	35.72	56.15
	11	H	H31K	TOCL2	1	1
	10.8	37.22	55.68
	12	C	C2	TOCL2	1	1
	14	34.62	59.79
	13	H	HG22	TOCL2	1	1
	14.9	34.08	59.45
	14	O	OG12	TOCL2	1	1
	14.24	35.23	61.07
	15	H	HO12	TOCL2	1	1
	13.37	35.49	61.36
	16	C	C1	TOCL2	1	1
	12.92	33.5	59.84
	17	H	HG11	TOCL2	1	1
	12.87	32.99	58.85
	18	H	HG12	TOCL2	1	1
	11.91	33.91	60.04
	19	P	P1	TOCL2	1	1
	12.41	31.33	61.19
	20	O	OP13	TOCL2	1	1
	13.22	30.4	62.01
	21	O	OP14	TOCL2	1	1
	11.13	31.8	61.75
	22	O	OP11	TOCL2	1	1
	13.33	32.57	60.83
	23	O	OP12	TOCL2	1	1
	12.08	30.57	59.83
	24	C	C11	TOCL2	1	1
	12.86	29.51	59.3
	25	H	H11J	TOCL2	1	1
	12.37	28.53	59.42
	26	H	H11K	TOCL2	1	1
	13.81	29.4	59.87
	27	C	C12	TOCL2	1	1
	13.09	29.78	57.78
	28	H	H12J	TOCL2	1	1
	13.54	30.79	57.72
	29	O	O12	TOCL2	1	1
	11.93	29.49	56.98
	30	C	CA1	TOCL2	1	1
	11.46	30.61	56.49
	31	O	OA1	TOCL2	1	1
	11.71	31.72	56.91
	32	C	CA2	TOCL2	1	1
	10.69	30.4	55.2
	33	H	H2A	TOCL2	1	1
	9.61	30.38	55.44
	34	H	H2B	TOCL2	1	1
	11.01	29.44	54.74
	35	C	C13	TOCL2	1	1
	14.13	28.9	57.19
	36	H	H13J	TOCL2	1	1
	13.48	28.01	57.35
	37	H	H13K	TOCL2	1	1
	14.99	29.03	57.86
	38	O	O13	TOCL2	1	1
	14.57	29.01	55.81
	39	C	CB1	TOCL2	1	1
	14.14	28.02	55.04
	40	O	OB1	TOCL2	1	1
	13.32	27.18	55.35
	41	C	CB2	TOCL2	1	1
	14.76	28.02	53.69
	42	H	H2D	TOCL2	1	1
	15.79	27.63	53.78
	43	H	H2E	TOCL2	1	1
	14.78	29.05	53.28
	44	C	C32	TOCL2	1	1
	12.52	36.63	54.43
	45	H	H32J	TOCL2	1	1
	11.94	35.88	53.85
	46	O	O32	TOCL2	1	1
	13.9	36.28	54.54
	47	C	CC1	TOCL2	1	1
	14.15	35.06	54.91
	48	O	OC1	TOCL2	1	1
	13.34	34.2	55.2
	49	C	CC2	TOCL2	1	1
	15.65	34.89	54.99
	50	H	H2R	TOCL2	1	1
	15.93	35.28	55.98
	51	H	H2S	TOCL2	1	1
	16.14	35.48	54.19
	52	C	C33	TOCL2	1	1
	12.49	37.93	53.63
	53	H	H33J	TOCL2	1	1
	11.46	38.35	53.67
	54	H	H33K	TOCL2	1	1
	13.12	38.68	54.15
	55	O	O33	TOCL2	1	1
	12.8	37.68	52.25
	56	C	CD1	TOCL2	1	1
	14.05	37.5	51.81
	57	O	OD1	TOCL2	1	1
	15.07	37.42	52.45
	58	C	CD2	TOCL2	1	1
	14.13	37.62	50.3
	59	H	H2X	TOCL2	1	1
	13.13	37.86	49.89
	60	H	H2Y	TOCL2	1	1
	14.53	36.62	50.17
	61	C	CA3	TOCL2	1	1
	11.03	31.46	54.14
	62	H	H3A	TOCL2	1	1
	11.18	32.48	54.56
	63	H	H3B	TOCL2	1	1
	10.19	31.48	53.41
	64	C	CA4	TOCL2	1	1
	12.36	31.02	53.52
	65	H	H4A	TOCL2	1	1
	12.26	29.99	53.13
	66	H	H4B	TOCL2	1	1
	13.11	31.03	54.34
	67	C	CA5	TOCL2	1	1
	12.95	31.95	52.45
	68	H	H5A	TOCL2	1	1
	13.98	31.57	52.24
	69	H	H5B	TOCL2	1	1
	13.03	32.97	52.88
	70	C	CA6	TOCL2	1	1
	12.18	31.92	51.14
	71	H	H6A	TOCL2	1	1
	11.11	32.14	51.36
	72	H	H6B	TOCL2	1	1
	12.23	30.89	50.74
	73	C	CA7	TOCL2	1	1
	12.73	32.82	50.02
	74	H	H7A	TOCL2	1	1
	11.98	32.85	49.2
	75	H	H7B	TOCL2	1	1
	13.64	32.33	49.59
	76	C	CA8	TOCL2	1	1
	13.08	34.27	50.41
	77	H	H8A	TOCL2	1	1
	13.51	34.73	49.49
	78	H	H8B	TOCL2	1	1
	13.91	34.34	51.14
	79	C	CA9	TOCL2	1	1
	11.9	35.07	50.92
	80	H	H9A	TOCL2	1	1
	11.74	34.98	52.01
	81	C	CA10	TOCL2	1	1
	10.99	35.68	50.13
	82	H	H10A	TOCL2	1	1
	10.27	36.39	50.57
	83	C	CA11	TOCL2	1	1
	10.95	35.66	48.62
	84	H	H11A	TOCL2	1	1
	11.86	35.16	48.2
	85	H	H11B	TOCL2	1	1
	10.94	36.69	48.22
	86	C	CA12	TOCL2	1	1
	9.66	34.95	48.12
	87	H	H12A	TOCL2	1	1
	8.8	35.52	48.53
	88	H	H12B	TOCL2	1	1
	9.65	33.92	48.55
	89	C	CA13	TOCL2	1	1
	9.54	34.89	46.57
	90	H	H13A	TOCL2	1	1
	10.46	34.33	46.3
	91	H	H13B	TOCL2	1	1
	9.58	35.9	46.12
	92	C	CA14	TOCL2	1	1
	8.3	34.16	46
	93	H	H14A	TOCL2	1	1
	7.39	34.78	46.1
	94	H	H14B	TOCL2	1	1
	8.23	33.23	46.63
	95	C	CA15	TOCL2	1	1
	8.32	33.72	44.51
	96	H	H15A	TOCL2	1	1
	7.35	33.2	44.32
	97	H	H15B	TOCL2	1	1
	9.15	32.99	44.41
	98	C	CA16	TOCL2	1	1
	8.43	34.83	43.43
	99	H	H16A	TOCL2	1	1
	9.26	35.52	43.64
	100	H	H16B	TOCL2	1	1
	7.47	35.4	43.45
	101	C	CA17	TOCL2	1	1
	8.67	34.3	42
	102	H	H17A	TOCL2	1	1
	8.11	33.34	41.9
	103	H	H17B	TOCL2	1	1
	9.76	34.11	41.84
	104	C	CA18	TOCL2	1	1
	8.25	35.23	40.86
	105	H	H18A	TOCL2	1	1
	8.29	36.28	41.24
	106	H	H18B	TOCL2	1	1
	7.23	35	40.51
	107	H	H18C	TOCL2	1	1
	8.91	35.1	39.97
	108	C	CB3	TOCL2	1	1
	13.93	27.03	52.85
	109	H	H3D	TOCL2	1	1
	12.86	27.26	52.73
	110	H	H3E	TOCL2	1	1
	13.9	26.06	53.32
	111	C	CB4	TOCL2	1	1
	14.57	26.74	51.55
	112	H	H4D	TOCL2	1	1
	14.03	25.98	50.95
	113	H	H4E	TOCL2	1	1
	15.61	26.41	51.82
	114	C	CB5	TOCL2	1	1
	14.68	27.93	50.69
	115	H	H5D	TOCL2	1	1
	15.02	27.45	49.74
	116	H	H5E	TOCL2	1	1
	15.42	28.59	51.21
	117	C	CB6	TOCL2	1	1
	13.54	28.73	50.27
	118	H	H6D	TOCL2	1	1
	13.94	29.73	49.98
	119	H	H6E	TOCL2	1	1
	12.95	28.77	51.19
	120	C	CB7	TOCL2	1	1
	12.83	28.08	49.09
	121	H	H7D	TOCL2	1	1
	12.33	27.16	49.45
	122	H	H7E	TOCL2	1	1
	13.55	27.79	48.29
	123	C	CB8	TOCL2	1	1
	11.74	28.97	48.52
	124	H	H8D	TOCL2	1	1
	11.11	29.37	49.34
	125	H	H8E	TOCL2	1	1
	11.09	28.3	47.91
	126	C	CB9	TOCL2	1	1
	12.31	30.12	47.75
	127	H	H9D	TOCL2	1	1
	13.04	30.73	48.31
	128	C	CB10	TOCL2	1	1
	11.93	30.49	46.52
	129	H	H10D	TOCL2	1	1
	12.38	31.38	46.06
	130	C	CB11	TOCL2	1	1
	10.87	29.83	45.69
	131	H	H11D	TOCL2	1	1
	10.23	30.61	45.23
	132	H	H11E	TOCL2	1	1
	10.19	29.19	46.3
	133	C	CB12	TOCL2	1	1
	11.45	28.87	44.67
	134	H	H12D	TOCL2	1	1
	12.1	28.13	45.19
	135	H	H12E	TOCL2	1	1
	12.11	29.4	43.94
	136	C	CB13	TOCL2	1	1
	10.41	28	43.96
	137	H	H13D	TOCL2	1	1
	9.82	27.39	44.68
	138	H	H13E	TOCL2	1	1
	10.97	27.29	43.31
	139	C	CB14	TOCL2	1	1
	9.41	28.8	43.13
	140	H	H14D	TOCL2	1	1
	8.91	29.61	43.67
	141	H	H14E	TOCL2	1	1
	8.62	28.11	42.85
	142	C	CB15	TOCL2	1	1
	10.12	29.35	41.92
	143	H	H15D	TOCL2	1	1
	10.44	28.43	41.37
	144	H	H15E	TOCL2	1	1
	11	29.89	42.31
	145	C	CB16	TOCL2	1	1
	9.38	30.39	41.08
	146	H	H16D	TOCL2	1	1
	8.77	31.08	41.66
	147	H	H16E	TOCL2	1	1
	8.68	29.85	40.39
	148	C	CB17	TOCL2	1	1
	10.27	31.55	40.55
	149	H	H17D	TOCL2	1	1
	11.17	31.27	40.09
	150	H	H17E	TOCL2	1	1
	11.18	31.78	41.11
	151	C	CB18	TOCL2	1	1
	9.74	32.39	39.37
	152	H	H18D	TOCL2	1	1
	10.54	32.68	38.64
	153	H	H18E	TOCL2	1	1
	9.44	33.31	39.81
	154	H	H18F	TOCL2	1	1
	8.95	31.87	38.77
	155	C	CC3	TOCL2	1	1
	16.05	33.41	54.86
	156	H	H3R	TOCL2	1	1
	15.41	32.77	55.5
	157	H	H3S	TOCL2	1	1
	17.08	33.25	55.23
	158	C	CC4	TOCL2	1	1
	16.1	32.97	53.42
	159	H	H4R	TOCL2	1	1
	15.25	33.32	52.79
	160	H	H4S	TOCL2	1	1
	16.11	31.85	53.42
	161	C	CC5	TOCL2	1	1
	17.32	33.47	52.71
	162	H	H5R	TOCL2	1	1
	18.15	33.58	53.45
	163	H	H5S	TOCL2	1	1
	17.27	34.48	52.26
	164	C	CC6	TOCL2	1	1
	17.6	32.52	51.57
	165	H	H6R	TOCL2	1	1
	17.92	31.51	51.91
	166	H	H6S	TOCL2	1	1
	18.44	33.09	51.2
	167	C	CC7	TOCL2	1	1
	16.65	32.42	50.45
	168	H	H7R	TOCL2	1	1
	15.73	32.12	50.99
	169	H	H7S	TOCL2	1	1
	17.01	31.64	49.76
	170	C	CC8	TOCL2	1	1
	16.5	33.67	49.57
	171	H	H8R	TOCL2	1	1
	16.41	34.56	50.22
	172	H	H8S	TOCL2	1	1
	15.53	33.44	49.1
	173	C	CC9	TOCL2	1	1
	17.52	33.93	48.49
	174	H	H9R	TOCL2	1	1
	18.49	34.34	48.82
	175	C	CC10	TOCL2	1	1
	17.43	33.52	47.2
	176	H	H10R	TOCL2	1	1
	18.27	33.68	46.51
	177	C	CC11	TOCL2	1	1
	16.35	32.74	46.57
	178	H	H11R	TOCL2	1	1
	16.4	32.76	45.46
	179	H	H11S	TOCL2	1	1
	15.35	33.11	46.86
	180	C	CC12	TOCL2	1	1
	16.51	31.3	47.01
	181	H	H12R	TOCL2	1	1
	15.98	31.19	47.98
	182	H	H12S	TOCL2	1	1
	17.59	31	47.16
	183	C	CC13	TOCL2	1	1
	15.75	30.49	45.95
	184	H	H13R	TOCL2	1	1
	16.34	30.41	45.01
	185	H	H13S	TOCL2	1	1
	14.68	30.71	45.93
	186	C	CC14	TOCL2	1	1
	15.66	29.09	46.18
	187	H	H14R	TOCL2	1	1
	15.23	28.97	47.22
	188	H	H14S	TOCL2	1	1
	16.73	28.76	45.69
	189	C	CC15	TOCL2	1	1
	14.97	28.02	45.67
	190	H	H15R	TOCL2	1	1
	13.97	27.88	46.11
	191	H	H15S	TOCL2	1	1
	15.8	27.28	46.1
	192	C	CC16	TOCL2	1	1
	15.03	28.25	44.23
	193	H	H16R	TOCL2	1	1
	15.02	29.22	43.93
	194	H	H16S	TOCL2	1	1
	16.15	28.03	44.17
	195	C	CC17	TOCL2	1	1
	14.03	27.61	43.16
	196	H	H17R	TOCL2	1	1
	13.01	27.52	43.51
	197	H	H17S	TOCL2	1	1
	13.66	26.64	43.46
	198	C	CC18	TOCL2	1	1
	14.51	27.51	41.54
	199	H	H18R	TOCL2	1	1
	14.68	28.52	41.54
	200	H	H18S	TOCL2	1	1
	15.55	27.06	41.14
	201	H	H18T	TOCL2	1	1
	13.97	26.77	40.93
	202	C	CD3	TOCL2	1	1
	15.19	38.51	49.61
	203	H	H3X	TOCL2	1	1
	16.14	38.64	50.17
	204	H	H3Y	TOCL2	1	1
	14.67	39.44	49.68
	205	C	CD4	TOCL2	1	1
	15.63	38.08	48.2
	206	H	H4X	TOCL2	1	1
	16.02	37.06	48.34
	207	H	H4Y	TOCL2	1	1
	16.48	38.71	47.87
	208	C	CD5	TOCL2	1	1
	14.64	38.05	47.03
	209	H	H5X	TOCL2	1	1
	15.03	38.81	46.31
	210	H	H5Y	TOCL2	1	1
	13.59	38.27	47.3
	211	C	CD6	TOCL2	1	1
	14.58	36.65	46.4
	212	H	H6X	TOCL2	1	1
	13.94	36.01	47.07
	213	H	H6Y	TOCL2	1	1
	15.63	36.27	46.4
	214	C	CD7	TOCL2	1	1
	14.04	36.58	44.95
	215	H	H7X	TOCL2	1	1
	14.74	37.14	44.3
	216	H	H7Y	TOCL2	1	1
	13.04	37.04	44.89
	217	C	CD8	TOCL2	1	1
	13.98	35.11	44.47
	218	H	H8X	TOCL2	1	1
	13.45	34.51	45.19
	219	H	H8Y	TOCL2	1	1
	15.04	34.75	44.49
	220	C	CD9	TOCL2	1	1
	13.5	34.38	43.29
	221	H	H9X	TOCL2	1	1
	12.38	34.42	43.11
	222	C	CD10	TOCL2	1	1
	14.19	34.69	42.22
	223	H	H10X	TOCL2	1	1
	13.62	34.26	41.29
	224	C	CD11	TOCL2	1	1
	15.4	35.86	42.03
	225	H	H11X	TOCL2	1	1
	16.22	35.95	42.77
	226	H	H11Y	TOCL2	1	1
	15.1	36.99	41.98
	227	C	CD12	TOCL2	1	1
	16.21	35.94	40.67
	228	H	H12X	TOCL2	1	1
	17.07	36.57	40.54
	229	H	H12Y	TOCL2	1	1
	15.91	36.61	39.85
	230	C	CD13	TOCL2	1	1
	16.24	34.55	40.13
	231	H	H13X	TOCL2	1	1
	16.47	34.41	39.03
	232	H	H13Y	TOCL2	1	1
	15.26	33.99	40.31
	233	C	CD14	TOCL2	1	1
	17.11	34	40.89
	234	H	H14X	TOCL2	1	1
	16.73	33.97	41.95
	235	H	H14Y	TOCL2	1	1
	18.06	34.55	40.63
	236	C	CD15	TOCL2	1	1
	16.97	32.69	40.29
	237	H	H15X	TOCL2	1	1
	17.54	32.69	39.32
	238	H	H15Y	TOCL2	1	1
	15.96	32.29	39.98
	239	C	CD16	TOCL2	1	1
	17.84	32.06	41.28
	240	H	H16X	TOCL2	1	1
	17.74	31.88	42.39
	241	H	H16Y	TOCL2	1	1
	18.67	32.74	41.02
	242	C	CD17	TOCL2	1	1
	18.03	30.77	40.8
	243	H	H17X	TOCL2	1	1
	19.19	30.44	41.36
	244	H	H17Y	TOCL2	1	1
	17.73	30.79	39.58
	245	C	CD18	TOCL2	1	1
	16.74	30.38	41.15
	246	H	H18X	TOCL2	1	1
	17.29	30.02	42.06
	247	H	H18Y	TOCL2	1	1
	16.24	29.42	40.88
	248	H	H18Z	TOCL2	1	1
	15.96	30.03	40.46

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

_cell.entry_id	TOCL2
_cell.length_a	50
_cell.length_b	50
_cell.length_c	50
_cell.angle_alpha	90
_cell.angle_beta	90
_cell.angle_gamma	90

