BP81OJ
  -OEChem-04012113473D

 20 20  0     0  0  0  0  0  0999 V2000
    2.3315   -1.8102   -0.9186 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1835   -0.0561   -0.1323 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.8525    1.1675   -1.1374 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4793    0.4983    0.6618 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8935    0.1704    1.1181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4931    0.0850    0.5753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1493   -1.1450    0.5289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1339    1.2352    0.1144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4462   -1.2251    0.0216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4309    1.1551   -0.3928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0869   -0.0751   -0.4392 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0382    1.1496    1.5919 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0367   -0.5663    1.9180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6644   -2.0483    0.8891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6343    2.1999    0.1449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9575   -2.1826   -0.0134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9300    2.0504   -0.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0968   -0.1373   -0.8338 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4029    1.2832   -1.9410 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3521    0.4820    0.2145 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 14  1  0  0  0  0
  8 10  2  0  0  0  0
  8 15  1  0  0  0  0
  9 11  2  0  0  0  0
  9 16  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
M  END

$$$$