# --------------------------------------------------------------------------
#
# 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 SSM.gro
#
#---------------------------------------------------------------------------

data_SSM

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

_entry.id	SSM

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

_chemical.entry_id	SSM
_chemical.name_common	'SSM'

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

_chemical_formula.entry_id	SSM
_chemical_formula.structural	'C41H84N2O6P'

###############
## 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	SSM	1	1
	71.57	67	60.94
	2	C	C15	SSM	1	1
	72.61	66.39	61.81
	3	H	H15A	SSM	1	1
	72.98	65.5	61.33
	4	H	H15B	SSM	1	1
	72.14	66.21	62.77
	5	H	H15C	SSM	1	1
	73.48	67.02	61.93
	6	C	C14	SSM	1	1
	71.06	68.27	61.56
	7	H	H14A	SSM	1	1
	71.77	69.09	61.45
	8	H	H14B	SSM	1	1
	70.82	68.17	62.61
	9	H	H14C	SSM	1	1
	70.14	68.59	61.05
	10	C	C13	SSM	1	1
	72.19	67.33	59.61
	11	H	H13A	SSM	1	1
	72.59	66.48	59.08
	12	H	H13B	SSM	1	1
	73.04	67.99	59.76
	13	H	H13C	SSM	1	1
	71.47	67.83	58.95
	14	C	C12	SSM	1	1
	70.4	66.03	60.83
	15	H	H12A	SSM	1	1
	70.05	65.8	61.83
	16	H	H12B	SSM	1	1
	70.77	65.14	60.35
	17	C	C11	SSM	1	1
	69.14	66.44	60.02
	18	H	H11A	SSM	1	1
	68.66	65.5	59.65
	19	H	H11B	SSM	1	1
	69.47	67.05	59.15
	20	P	P	SSM	1	1
	67.06	68.03	60.12
	21	O	O13	SSM	1	1
	66.57	67.36	58.89
	22	O	O14	SSM	1	1
	66.07	68.42	61.13
	23	O	O11	SSM	1	1
	67.87	69.34	59.74
	24	O	O12	SSM	1	1
	68.21	67.14	60.84
	25	C	C1S	SSM	1	1
	67.24	70.52	59.26
	26	H	H1S	SSM	1	1
	67.84	71.4	59.58
	27	H	H1T	SSM	1	1
	66.24	70.69	59.72
	28	N	NF	SSM	1	1
	68.14	71.24	57.04
	29	H	HNF	SSM	1	1
	67.86	72.09	56.61
	30	C	C2S	SSM	1	1
	67.14	70.44	57.72
	31	H	H2S	SSM	1	1
	67.28	69.39	57.38
	32	C	C3S	SSM	1	1
	65.79	70.91	57.31
	33	H	H3S	SSM	1	1
	65.81	71.98	57.46
	34	O	O3	SSM	1	1
	64.6	70.55	57.93
	35	H	HO3	SSM	1	1
	64.76	70.16	58.79
	36	C	C4S	SSM	1	1
	65.7	70.61	55.88
	37	H	H4S	SSM	1	1
	65.99	71.53	55.41
	38	C	C5S	SSM	1	1
	65.39	69.48	55.21
	39	H	H5S	SSM	1	1
	65.36	68.65	55.9
	40	C	C6S	SSM	1	1
	65.25	69.14	53.7
	41	H	H6S	SSM	1	1
	64.76	69.86	53.06
	42	H	H6T	SSM	1	1
	64.47	68.39	53.51
	43	C	C7S	SSM	1	1
	66.53	68.89	52.9
	44	H	H7S	SSM	1	1
	67	68.11	53.53
	45	H	H7T	SSM	1	1
	67.1	69.85	52.91
	46	C	C8S	SSM	1	1
	66.26	68.41	51.45
	47	H	H8S	SSM	1	1
	66.16	69.26	50.74
	48	H	H8T	SSM	1	1
	65.26	67.93	51.43
	49	C	C9S	SSM	1	1
	67.31	67.41	50.9
	50	H	H9S	SSM	1	1
	67.82	66.87	51.73
	51	H	H9T	SSM	1	1
	68.12	67.99	50.4
	52	C	C10S	SSM	1	1
	66.79	66.38	49.87
	53	H	H10S	SSM	1	1
	66	65.73	50.31
	54	H	H10T	SSM	1	1
	67.66	65.74	49.6
	55	C	C11S	SSM	1	1
	66.31	67.01	48.56
	56	H	H11S	SSM	1	1
	67.2	67.5	48.1
	57	H	H11T	SSM	1	1
	65.53	67.77	48.75
	58	C	C12S	SSM	1	1
	65.79	66.07	47.46
	59	H	H12S	SSM	1	1
	64.8	65.65	47.74
	60	H	H12T	SSM	1	1
	66.47	65.2	47.4
	61	C	C13S	SSM	1	1
	65.7	66.85	46.13
	62	H	H13S	SSM	1	1
	66.14	67.87	46.26
	63	H	H13T	SSM	1	1
	64.63	66.96	45.85
	64	C	C14S	SSM	1	1
	66.46	66.19	44.96
	65	H	H14S	SSM	1	1
	65.84	65.33	44.63
	66	H	H14T	SSM	1	1
	67.44	65.8	45.29
	67	C	C15S	SSM	1	1
	66.71	67.1	43.75
	68	H	H15S	SSM	1	1
	67.46	67.91	43.94
	69	H	H15T	SSM	1	1
	65.75	67.6	43.49
	70	C	C16S	SSM	1	1
	67.14	66.24	42.55
	71	H	H16S	SSM	1	1
	66.19	65.91	42.08
	72	H	H16T	SSM	1	1
	67.7	65.33	42.86
	73	C	C17S	SSM	1	1
	68.01	66.94	41.52
	74	H	H17S	SSM	1	1
	67.92	68.04	41.68
	75	H	H17T	SSM	1	1
	67.64	66.66	40.5
	76	C	C18S	SSM	1	1
	69.47	66.5	41.62
	77	H	H18S	SSM	1	1
	69.79	66.34	42.66
	78	H	H18T	SSM	1	1
	70.14	67.26	41.2
	79	H	H18U	SSM	1	1
	69.61	65.53	41.1
	80	C	C1F	SSM	1	1
	69.4	70.88	57.05
	81	O	OF	SSM	1	1
	69.83	69.97	57.74
	82	C	C2F	SSM	1	1
	70.26	71.67	56.13
	83	H	H2F	SSM	1	1
	71.09	72.13	56.71
	84	H	H2G	SSM	1	1
	69.64	72.46	55.66
	85	C	C3F	SSM	1	1
	70.77	70.77	55
	86	H	H3F	SSM	1	1
	71.09	69.79	55.43
	87	H	H3G	SSM	1	1
	71.66	71.27	54.55
	88	C	C4F	SSM	1	1
	69.77	70.49	53.86
	89	H	H4F	SSM	1	1
	69.68	71.43	53.27
	90	H	H4G	SSM	1	1
	68.76	70.25	54.26
	91	C	C5F	SSM	1	1
	70.22	69.35	52.92
	92	H	H5F	SSM	1	1
	69.3	69.04	52.38
	93	H	H5G	SSM	1	1
	70.61	68.46	53.46
	94	C	C6F	SSM	1	1
	71.25	69.78	51.84
	95	H	H6F	SSM	1	1
	72.23	70.05	52.29
	96	H	H6G	SSM	1	1
	70.85	70.7	51.35
	97	C	C7F	SSM	1	1
	71.46	68.71	50.75
	98	H	H7F	SSM	1	1
	70.46	68.58	50.27
	99	H	H7G	SSM	1	1
	71.77	67.76	51.23
	100	C	C8F	SSM	1	1
	72.45	69.1	49.63
	101	H	H8F	SSM	1	1
	73.49	69.27	49.98
	102	H	H8G	SSM	1	1
	72.11	70.08	49.25
	103	C	C9F	SSM	1	1
	72.58	68.1	48.46
	104	H	H9F	SSM	1	1
	73.26	67.27	48.76
	105	H	H9G	SSM	1	1
	73.07	68.67	47.65
	106	C	C10F	SSM	1	1
	71.29	67.41	47.95
	107	H	H10F	SSM	1	1
	70.83	66.88	48.81
	108	H	H10G	SSM	1	1
	71.58	66.63	47.2
	109	C	C11F	SSM	1	1
	70.24	68.3	47.26
	110	H	H11F	SSM	1	1
	69.9	69.08	47.98
	111	H	H11G	SSM	1	1
	69.36	67.68	46.98
	112	C	C12F	SSM	1	1
	70.78	68.97	45.99
	113	H	H12F	SSM	1	1
	71.13	68.21	45.26
	114	H	H12G	SSM	1	1
	71.61	69.62	46.32
	115	C	C13F	SSM	1	1
	69.75	69.86	45.29
	116	H	H13F	SSM	1	1
	69.3	70.52	46.07
	117	H	H13G	SSM	1	1
	68.95	69.2	44.91
	118	C	C14F	SSM	1	1
	70.31	70.67	44.1
	119	H	H14F	SSM	1	1
	70.75	69.98	43.33
	120	H	H14G	SSM	1	1
	71.09	71.38	44.44
	121	C	C15F	SSM	1	1
	69.19	71.4	43.34
	122	H	H15F	SSM	1	1
	68.49	71.87	44.07
	123	H	H15G	SSM	1	1
	68.67	70.56	42.81
	124	C	C16F	SSM	1	1
	69.63	72.4	42.27
	125	H	H16F	SSM	1	1
	70.16	71.81	41.49
	126	H	H16G	SSM	1	1
	70.36	73.16	42.62
	127	C	C17F	SSM	1	1
	68.4	73.1	41.61
	128	H	H17F	SSM	1	1
	67.66	72.3	41.36
	129	H	H17G	SSM	1	1
	68.75	73.56	40.67
	130	C	C18F	SSM	1	1
	67.67	74.17	42.43
	131	H	H18F	SSM	1	1
	68.38	74.87	42.89
	132	H	H18G	SSM	1	1
	67.12	73.71	43.26
	133	H	H18H	SSM	1	1
	66.96	74.79	41.83

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

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

