NCI:332775
BBtclserve11129919062D 0   0.00000     0.00000176332
94128-90-2
 20 21  0  0  0  0  0  0  0  0  2 V2000
    3.9538    1.7014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5471    2.6149    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660    0.8924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1349    3.4239    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6751   -0.0587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660    0.8924    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7282    4.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.6465    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0570   -0.0587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3159    5.1465    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7336    4.4420    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -3.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -3.6465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -4.6465    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -5.1465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -5.1465    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
  8  9  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  2  18   1  20  -1
M  END