# --------------------------------------------------------------------------
#
# 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 LSM.gro
#
#---------------------------------------------------------------------------

data_LSM

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

_entry.id	LSM

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

_chemical.entry_id	LSM
_chemical.name_common	'LSM'

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

_chemical_formula.entry_id	LSM
_chemical_formula.structural	'C47H100N2O6P'

###############
## 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	N	N	LSM	1	1
	74.7	73.01	67.64
	2	C	C15	LSM	1	1
	74.07	72.38	68.83
	3	H	H15A	LSM	1	1
	74.71	72.48	69.71
	4	H	H15B	LSM	1	1
	73.92	71.32	68.69
	5	H	H15C	LSM	1	1
	73.12	72.86	69.05
	6	C	C14	LSM	1	1
	76.08	72.46	67.46
	7	H	H14A	LSM	1	1
	76.49	72.8	66.51
	8	H	H14B	LSM	1	1
	76.09	71.38	67.43
	9	H	H14C	LSM	1	1
	76.76	72.82	68.21
	10	C	C13	LSM	1	1
	73.97	72.68	66.36
	11	H	H13A	LSM	1	1
	73.25	73.43	66.01
	12	H	H13B	LSM	1	1
	73.5	71.72	66.46
	13	H	H13C	LSM	1	1
	74.69	72.6	65.55
	14	C	C12	LSM	1	1
	74.75	74.51	67.92
	15	H	H12A	LSM	1	1
	75.17	74.64	68.92
	16	H	H12B	LSM	1	1
	73.73	74.87	67.97
	17	C	C11	LSM	1	1
	75.49	75.44	66.94
	18	H	H11A	LSM	1	1
	76.55	75.1	66.88
	19	H	H11B	LSM	1	1
	75.46	76.48	67.36
	20	P	P	LSM	1	1
	73.57	76.15	65.35
	21	O	O13	LSM	1	1
	72.48	75.28	65.83
	22	O	O14	LSM	1	1
	73.75	77.47	65.99
	23	O	O11	LSM	1	1
	73.58	76.27	63.79
	24	O	O12	LSM	1	1
	74.93	75.38	65.63
	25	C	C1S	LSM	1	1
	73.52	75.11	62.98
	26	H	H1S	LSM	1	1
	72.53	74.61	63.07
	27	H	H1T	LSM	1	1
	74.32	74.38	63.22
	28	N	NF	LSM	1	1
	75.15	75.89	61.31
	29	H	HNF	LSM	1	1
	75.27	76.86	61.26
	30	C	C2S	LSM	1	1
	73.76	75.57	61.54
	31	H	H2S	LSM	1	1
	73.47	74.76	60.82
	32	C	C3S	LSM	1	1
	72.87	76.77	61.24
	33	H	H3S	LSM	1	1
	73.14	77.62	61.91
	34	O	O3	LSM	1	1
	71.48	76.53	61.36
	35	H	HO3	LSM	1	1
	71.43	76.13	62.23
	36	C	C4S	LSM	1	1
	73.19	77.13	59.85
	37	H	H4S	LSM	1	1
	73.83	77.99	59.91
	38	C	C5S	LSM	1	1
	73.05	76.49	58.67
	39	H	H5S	LSM	1	1
	72.75	75.44	58.67
	40	C	C6S	LSM	1	1
	73.42	77.01	57.31
	41	H	H6S	LSM	1	1
	73.38	76.26	56.49
	42	H	H6T	LSM	1	1
	74.36	77.59	57.26
	43	C	C7S	LSM	1	1
	72.26	77.89	57.01
	44	H	H7S	LSM	1	1
	71.96	78.71	57.67
	45	H	H7T	LSM	1	1
	71.43	77.23	56.96
	46	C	C8S	LSM	1	1
	72.42	78.61	55.76
	47	H	H8S	LSM	1	1
	73.24	79.19	56.3
	48	H	H8T	LSM	1	1
	71.9	79.55	55.7
	49	C	C9S	LSM	1	1
	72.6	77.68	54.44
	50	H	H9S	LSM	1	1
	71.72	77.06	54.27
	51	H	H9T	LSM	1	1
	73.57	77.17	54.45
	52	C	C10S	LSM	1	1
	72.48	78.2	52.95
	53	H	H10S	LSM	1	1
	73.42	78.61	53.04
	54	H	H10T	LSM	1	1
	71.89	79.03	52.58
	55	C	C11S	LSM	1	1
	73.01	77.73	51.69
	56	H	H11S	LSM	1	1
	72.38	76.93	51.4
	57	H	H11T	LSM	1	1
	73.98	77.23	52.11
	58	C	C12S	LSM	1	1
	72.89	78.77	50.43
	59	H	H12S	LSM	1	1
	73.11	79.95	50.45
	60	H	H12T	LSM	1	1
	72.07	79.46	50.31
	61	C	C13S	LSM	1	1
	73.62	77.87	49.24
	62	H	H13S	LSM	1	1
	72.9	77.17	48.87
	63	H	H13T	LSM	1	1
	74.67	77.46	49.41
	64	C	C14S	LSM	1	1
	73.85	78.4	47.79
	65	H	H14S	LSM	1	1
	74.8	78.93	47.61
	66	H	H14T	LSM	1	1
	72.92	78.99	47.82
	67	C	C15S	LSM	1	1
	74.26	77.68	46.57
	68	H	H15S	LSM	1	1
	73.34	77.1	46.6
	69	H	H15T	LSM	1	1
	75.31	77.32	46.65
	70	C	C16S	LSM	1	1
	74.29	78.37	45.27
	71	H	H16S	LSM	1	1
	75.24	78.93	44.98
	72	H	H16T	LSM	1	1
	73.26	78.78	45.35
	73	C	C17S	LSM	1	1
	73.94	77.63	44.09
	74	H	H17S	LSM	1	1
	73.26	76.88	44.45
	75	H	H17T	LSM	1	1
	74.98	77.38	43.79
	76	C	C18S	LSM	1	1
	73.17	78.4	43.07
	77	H	H18S	LSM	1	1
	73.51	77.9	42.22
	78	H	H18T	LSM	1	1
	73.45	79.42	43.18
	79	H	H18U	LSM	1	1
	72.1	78.49	43
	80	C	C1F	LSM	1	1
	76.14	75.01	61.24
	81	O	OF	LSM	1	1
	75.97	73.81	61.31
	82	C	C2F	LSM	1	1
	77.51	75.57	61.07
	83	H	H2F	LSM	1	1
	78.15	75.15	61.88
	84	H	H2G	LSM	1	1
	77.45	76.65	61.22
	85	C	C3F	LSM	1	1
	78.09	75.25	59.67
	86	H	H3F	LSM	1	1
	78.32	74.18	59.66
	87	H	H3G	LSM	1	1
	79.04	75.81	59.52
	88	C	C4F	LSM	1	1
	77.12	75.43	58.48
	89	H	H4F	LSM	1	1
	76.73	76.46	58.53
	90	H	H4G	LSM	1	1
	76.28	74.7	58.48
	91	C	C5F	LSM	1	1
	77.8	75.35	57.13
	92	H	H5F	LSM	1	1
	78.21	74.32	56.97
	93	H	H5G	LSM	1	1
	78.59	76.11	57.29
	94	C	C6F	LSM	1	1
	77.06	75.96	55.93
	95	H	H6F	LSM	1	1
	77.79	76.17	55.1
	96	H	H6G	LSM	1	1
	76.71	76.95	56.27
	97	C	C7F	LSM	1	1
	75.93	75.11	55.37
	98	H	H7F	LSM	1	1
	75.28	75.68	54.66
	99	H	H7G	LSM	1	1
	75.3	74.8	56.23
	100	C	C8F	LSM	1	1
	76.46	73.85	54.67
	101	H	H8F	LSM	1	1
	75.7	73.06	54.72
	102	H	H8G	LSM	1	1
	77.31	73.5	55.28
	103	C	C9F	LSM	1	1
	76.82	74.03	53.18
	104	H	H9F	LSM	1	1
	77.49	73.21	52.83
	105	H	H9G	LSM	1	1
	77.34	75	53.01
	106	C	C10F	LSM	1	1
	75.56	74.05	52.31
	107	H	H10F	LSM	1	1
	74.98	74.93	52.67
	108	H	H10G	LSM	1	1
	74.94	73.14	52.49
	109	C	C11F	LSM	1	1
	75.84	74.33	50.83
	110	H	H11F	LSM	1	1
	76.69	73.74	50.45
	111	H	H11G	LSM	1	1
	76.06	75.42	50.71
	112	C	C12F	LSM	1	1
	74.61	74.08	49.96
	113	H	H12F	LSM	1	1
	73.78	74.69	50.38
	114	H	H12G	LSM	1	1
	74.37	72.99	50.02
	115	C	C13F	LSM	1	1
	74.82	74.51	48.5
	116	H	H13F	LSM	1	1
	75.5	73.79	48
	117	H	H13G	LSM	1	1
	75.34	75.5	48.48
	118	C	C14F	LSM	1	1
	73.49	74.58	47.7
	119	H	H14F	LSM	1	1
	72.85	75.38	48.09
	120	H	H14G	LSM	1	1
	72.95	73.62	47.85
	121	C	C15F	LSM	1	1
	73.67	74.73	46.18
	122	H	H15F	LSM	1	1
	74.61	75.3	46.01
	123	H	H15G	LSM	1	1
	72.84	75.32	45.71
	124	C	C16F	LSM	1	1
	73.76	73.33	45.58
	125	H	H16F	LSM	1	1
	72.73	72.9	45.54
	126	H	H16G	LSM	1	1
	74.37	72.73	46.29
	127	C	C17F	LSM	1	1
	74.4	73.22	44.21
	128	H	H17F	LSM	1	1
	73.99	74.05	43.59
	129	H	H17G	LSM	1	1
	74.04	72.25	43.79
	130	C	C18F	LSM	1	1
	75.95	73.22	44.26
	131	H	H18F	LSM	1	1
	76.32	72.17	44.19
	132	H	H18G	LSM	1	1
	76.29	73.64	45.22
	133	C	C19F	LSM	1	1
	76.61	74.01	43.13
	134	H	H19F	LSM	1	1
	77.72	74.05	43.24
	135	H	H19G	LSM	1	1
	76.19	75.04	43.11
	136	C	C20F	LSM	1	1
	76.36	73.35	41.78
	137	H	H20F	LSM	1	1
	75.26	73.45	41.63
	138	H	H20G	LSM	1	1
	76.62	72.28	41.83
	139	C	C21F	LSM	1	1
	77.25	73.92	40.66
	140	H	H21F	LSM	1	1
	76.87	73.51	39.69
	141	H	H21G	LSM	1	1
	78.29	73.61	40.7
	142	C	C22F	LSM	1	1
	77.19	75.39	40.58
	143	H	H22F	LSM	1	1
	77.87	75.93	39.89
	144	H	H22G	LSM	1	1
	77.2	76	41.53
	145	C	C23F	LSM	1	1
	75.85	75.24	39.9
	146	H	H23F	LSM	1	1
	74.91	75.06	40.54
	147	H	H23G	LSM	1	1
	75.83	75.03	38.81
	148	C	C24F	LSM	1	1
	75.59	76.3	39.28
	149	H	H24F	LSM	1	1
	75.72	76.63	40.44
	150	H	H24G	LSM	1	1
	74.48	76.29	38.88
	151	H	H24H	LSM	1	1
	76.13	77.14	38.85

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

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

