NCI:368691
BBtclserve11129919172D 0   0.00000     0.00000185769
999-99-9
 17 18  0  0  0  0  0  0  0  0  2 V2000
    5.4049   -1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4049   -2.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4049   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5388   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2709   -0.2500    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.5388    0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5878   -0.5590    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    7.1369   -0.7500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.2709    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4049    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5878    1.0590    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.2500    0.0000 Ca  0  0  0  0  0  0  0  0  0  0  0  0
    7.1369    1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4049    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1369    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2709    2.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  4  6  1  0  0  0  0
  4  7  2  0  0  0  0
  5  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 16 17  2  0  0  0  0
M  CHG  3   5   1   7   1   8  -1
M  END