atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4731   -0.9553    3.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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  9 29  1  0  0  0  0
 10 30  1  0  0  0  0
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
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 11 14  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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    0.3561    2.3299    3.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4586   -4.8113   -6.0759 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9087    4.4113   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0970    1.2576   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9087    4.4113   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0970    1.2576   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 20  1  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
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 13 16  1  0  0  0  0
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  1 20  1  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4609   -3.2655    1.4887 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6899   -0.5013   -0.2605 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7606   -3.8829   -4.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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  1 20  1  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3561    2.3299    3.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3561    2.3299    3.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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    3.4201   -3.6771    0.5157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2701   -3.7816   -3.8064 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5381   -0.1698    4.0588 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3561    2.3299    3.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4575   -4.8111   -6.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3177   -0.0633    1.1056 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 11 14  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2701   -3.7816   -3.8064 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.6796   -2.8835   -2.9173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8258   -3.8505   -5.1269 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5945    4.1858   -0.2948 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9087    4.4113   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4575   -4.8111   -6.0769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0970    1.2576   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7366    3.5575   -0.6865 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3561    2.3299    3.8554 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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  8 24  1  0  0  0  0
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  8 26  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
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 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2701   -3.7816   -3.8064 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.4731   -0.9553    3.0484 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7018   -2.5669   -6.5701 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4663    0.8417    1.7964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5573    1.7657   -0.4255 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
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  4  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6 19  1  0  0  0  0
  7 10  1  0  0  0  0
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  8 13  1  0  0  0  0
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 11 14  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
  2 21  1  0  0  0  0
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 10 30  1  0  0  0  0
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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    4.5258    0.6052   -0.7063 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4663    0.8417    1.7964 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9087    4.4113   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0970    1.2576   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.6636   -0.5412   -7.4674 N   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9087    4.4113   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7018   -2.5669   -6.5701 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0970    1.2576   -0.9369 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4663    0.8417    1.7964 C   0  0  0  0  0  0  0  0  0  0  0  0
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7919   -3.0214   -5.5579 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4663    0.8417    1.7964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7018   -2.5669   -6.5701 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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    2.0528    0.1127    0.2116 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6 19  1  0  0  0  0
  7 10  1  0  0  0  0
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  7 17  2  0  0  0  0
  8 13  1  0  0  0  0
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 11 14  1  0  0  0  0
 11 16  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0554    1.5878    4.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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  1 20  1  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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    0.2925   -0.6529    4.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 13 16  1  0  0  0  0
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  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 20  1  0  0  0  0
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  4 23  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
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 14 18  1  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9589   -3.1779   -0.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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   -3.6428    0.7848    2.5414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6271   -1.5133    2.4399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4587   -4.8110   -6.0761 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.5754   -3.3098   -4.0806 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
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 11 14  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.4867   -3.4934   -5.2837 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.1037   -2.5950   -4.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -0.7911   -3.0210   -5.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
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  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7420   -2.1989   -5.4896 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0936    2.6638    0.7138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7018   -2.5669   -6.5701 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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  1 20  1  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4704    1.5142    2.7412 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 14 18  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
    0.7618   -3.8827   -4.8037 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.6881   -1.3244   -5.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  5  1  0  0  0  0
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 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.8974   -2.7284   -4.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887   -1.3252   -5.7603 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4005   -3.0816    2.3940 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -2.2710   -3.7821   -3.8054 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
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 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
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 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
   -1.2174   -4.4827   -3.5519 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7606   -3.8829   -4.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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    0.1740    0.8404   -0.8189 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5066   -7.4190   -6.3473 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9732   -8.5388   -5.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1428    0.0683    1.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0528    0.1127    0.2116 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  4  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6 19  1  0  0  0  0
  7 10  1  0  0  0  0
  7 15  1  0  0  0  0
  7 17  2  0  0  0  0
  8 13  1  0  0  0  0
  9 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  1  0  0  0  0
 12 19  1  0  0  0  0
 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 22  1  0  0  0  0
  4 23  1  0  0  0  0
  8 24  1  0  0  0  0
  8 25  1  0  0  0  0
  8 26  1  0  0  0  0
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  9 29  1  0  0  0  0
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 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
atenolol
  -OEChem-10202512563D

 41 41  0     1  0  0  0  0  0999 V2000
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   -2.8966   -2.7276   -4.2095 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.9011   -1.6393   -6.6678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2609    2.0847    0.3906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5624    2.5111    2.1951 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7008   -2.5663   -6.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3177   -0.0633    1.1056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5729   -1.1605   -1.1463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8633    1.7619    0.9031 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2075   -0.1385   -0.3269 C   0  0  2  0  0  0  0  0  0  0  0  0
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   -1.7105    0.3234    1.1035 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.2781    2.2486    2.9824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6065    3.5934    2.0391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5613    2.2619    2.5646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0704   -3.5941   -6.4198 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2456    0.6739    1.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6361   -0.9020   -1.1949 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.1294    2.0493    0.1417 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1740    0.8404   -0.8189 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.3820    0.1600   -7.6187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1428    0.0683    1.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0528    0.1127    0.2116 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
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  5 10  1  0  0  0  0
  6 19  1  0  0  0  0
  7 10  1  0  0  0  0
  7 15  1  0  0  0  0
  7 17  2  0  0  0  0
  8 13  1  0  0  0  0
  9 13  1  0  0  0  0
 11 14  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  1  0  0  0  0
 12 19  1  0  0  0  0
 13 16  1  0  0  0  0
 14 18  1  0  0  0  0
  1 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 22  1  0  0  0  0
  4 23  1  0  0  0  0
  8 24  1  0  0  0  0
  8 25  1  0  0  0  0
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  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
  9 29  1  0  0  0  0
 10 30  1  0  0  0  0
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 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
 18 41  1  0  0  0  0
M  END
$$$$
