#------------------------------------------------------------------------------
#$Date: 2008-01-26 13:05:32 +0000 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: svn://www.crystallography.net/cod/cif/2/2004743.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2004743
_journal_name_full  'Acta Crystallographica'
_journal_year      1996
_journal_volume    	C52
_journal_page_first    	913
_journal_page_last    	919
_publ_section_title    	
;
Structures of Five \w-Phthalimidoaliphatic Carboxylic Acids
;
_chemical_formula_sum    	'C11 H9 N1 O4'
_chemical_formula_weight    	219.1
_symmetry_cell_setting    	monoclinic
_symmetry_space_group_name_H-M    	'P 21/c'
_cell_length_a    	7.079(4)
_cell_length_b    	8.949(5)
_cell_length_c    	15.893(7)
_cell_angle_alpha    	90
_cell_angle_beta    	98.84(4)
_cell_angle_gamma    	90
_cell_volume    	995(1)
_cell_formula_units_Z    	4
_exptl_crystal_density_diffrn    	1.46
_cell_measurement_temperature    	295
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
N(1) .6850(4) -.0063(3) .6410(2) .058(2)
O(7) .6635(4) .1691(3) .7448(2) .061(2)
O(8) .7333(4) -.1208(3) .5174(2) .054(2)
O(110) .8496(5) -.4359(3) .8034(2) .071(2)
O(111) .7693(4) -.2365(3) .8718(2) .057(2)
C(1) .7412(5) .1509(4) .5334(2) .037(2)
C(2) .7735(5) .2131(4) .4572(2) .047(2)
C(3) .7766(6) .3674(5) .4533(2) .052(3)
C(4) .7520(6) .4561(5) .5222(3) .055(3)
C(5) .7207(6) .3923(4) .5987(2) .050(2)
C(6) .7168(5) .2387(4) .6022(2) .039(2)
C(7) .6846(5) .1393(4) .6729(2) .041(2)
C(8) .7223(5) -.0081(4) .5582(2) .038(2)
C(9) .6596(5) -.1376(4) .6916(2) .044(2)
C(10) .8488(6) -.1974(5) .7360(2) .054(3)
C(11) .8229(5) -.3047(4) .8054(2) .043(2)
H(2) .7949(5) .1441(4) .4037(2) ?
H(3) .7982(6) .4209(5) .3947(2) ?
H(4) .7578(6) .5763(5) .5165(3) ?
H(5) .7004(6) .4598(4) .6530(2) ?
H(91) .5707(5) -.1096(4) .7388(2) ?
H(92) .5911(5) -.2239(4) .6502(2) ?
H(101) .9330(6) -.1040(5) .7636(2) ?
H(102) .9228(6) -.2526(5) .6902(2) ?
H(111) .7659(63) -.3112(52) .9125(28) ?