# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'MLN' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 2.97500 -0.88800 0.13500 1.000 P1 P 4.51500 -0.72000 0.60000 1.000 O2 O 5.47200 -1.72300 0.02400 1.000 O3 O 4.85500 0.82400 0.25800 1.000 O4 O 4.41800 -0.71800 2.21400 1.000 C5 C 4.89100 1.22200 -1.10400 1.000 C6 C 5.96000 0.40400 -1.81700 1.000 C7 C 5.17400 2.72400 -1.21400 1.000 C8 C 4.09400 3.56400 -0.52200 1.000 C9 C 4.33800 5.07100 -0.63000 1.000 C10 C 3.23100 5.91100 -0.01100 1.000 O11 O 6.99200 0.03700 -1.25900 1.000 N12 N 5.62100 0.11700 -3.13100 1.000 C13 C 6.46600 -0.66200 -4.00500 1.000 C14 C 5.66100 -1.39800 -5.08500 1.000 C15 C 4.65600 -2.43700 -4.54700 1.000 C16 C 5.39400 -3.48200 -3.70600 1.000 C17 C 3.54600 -1.79500 -3.71300 1.000 C18 C 7.46000 0.30300 -4.65300 1.000 N19 N 8.68300 -0.32200 -4.88900 1.000 O20 O 7.15000 1.45400 -4.94600 1.000 C21 C 9.84300 0.24200 -5.47100 1.000 C22 C 10.97300 -0.54400 -5.62700 1.000 C23 C 12.11600 0.01200 -6.20100 1.000 C24 C 12.11300 1.34600 -6.61000 1.000 C25 C 10.96700 2.12300 -6.44500 1.000 C26 C 9.82400 1.56700 -5.87100 1.000 N27 N 13.27700 1.91100 -7.19400 1.000 O28 O 14.29800 1.19500 -7.33300 1.000 O29 O 13.25400 3.11300 -7.55500 1.000 H30 H 2.55900 -1.77500 0.18300 1.000 H31 H 4.30800 -1.57100 2.68400 1.000 H32 H 3.91700 0.98100 -1.54400 1.000 H33 H 6.14700 2.93800 -0.75600 1.000 H34 H 5.24600 3.01900 -2.26800 1.000 H35 H 4.02000 3.28300 0.53600 1.000 H36 H 3.12200 3.34100 -0.97800 1.000 H37 H 4.42200 5.33300 -1.69200 1.000 H38 H 5.29600 5.32900 -0.16400 1.000 H39 H 3.41300 6.97300 -0.20500 1.000 H40 H 2.25600 5.65100 -0.43600 1.000 H41 H 3.18400 5.77600 1.07300 1.000 H42 H 4.72600 0.43000 -3.49400 1.000 H43 H 7.01700 -1.36400 -3.37100 1.000 H44 H 5.11500 -0.65700 -5.68500 1.000 H45 H 6.35200 -1.89400 -5.77900 1.000 H46 H 4.19300 -2.96000 -5.39200 1.000 H47 H 6.16800 -3.98200 -4.29800 1.000 H48 H 5.87700 -3.02400 -2.83500 1.000 H49 H 4.70300 -4.25000 -3.34500 1.000 H50 H 3.96000 -1.20300 -2.89000 1.000 H51 H 2.89300 -2.56200 -3.28200 1.000 H52 H 2.91600 -1.14100 -4.32300 1.000 H53 H 8.76600 -1.30000 -4.61800 1.000 H54 H 10.98600 -1.58400 -5.31200 1.000 H55 H 13.00300 -0.60500 -6.32400 1.000 H56 H 10.95200 3.16400 -6.75900 1.000 H57 H 8.93600 2.18300 -5.74800 1.000