NCI:18873
BBtclserve11129916472D 0   0.00000     0.00000 17669
5453-74-7
 16 17  0  0  0  0  0  0  0  0  2 V2000
    4.9921    0.5329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3230    1.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6831   -0.4181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6320    2.2271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3448    1.0682    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -0.7271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2709   -1.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.7271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2709   -1.2271    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.6831   -2.0362    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.2271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.7271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7709   -2.0932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7709   -0.3611    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.7271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  6  8  2  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  2  0  0  0  0
 10 15  1  0  0  0  0
 12 16  2  0  0  0  0
  8 11  1  0  0  0  0
 13 16  1  0  0  0  0
M  CHG  2  10   1  15  -1
M  END