B8RA3F
  -OEChem-04012119392D

 43 44  0     1  0  0  0  0  0999 V2000
    3.0000    0.1659    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.0000    0.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9680    0.4666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    1.1659    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    5.5032    2.1138    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8090    1.7537    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.5000    2.7048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    2.7048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1910    1.7537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7601    1.4447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -0.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4543    1.8048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1974    2.4740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1340   -1.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8660   -1.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1485    2.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1340   -2.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8660   -2.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -2.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8916    2.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9060    1.1414    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1064    2.8337    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4352    3.3214    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5648    3.3214    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8936    2.8337    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6246    2.0059    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8810    1.2168    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3743    2.7203    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1632    1.2574    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9428    1.4231    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4885    3.0214    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7088    2.8557    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5970   -1.0241    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4030   -1.0241    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8574    1.6175    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6370    1.7832    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5970   -2.6441    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4030   -2.6441    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000   -3.4541    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3065    2.3733    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3524    3.2489    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4768    3.2948    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  5  1  0  0  0  0
  1 12  1  0  0  0  0
  4 11  2  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 13  1  0  0  0  0
  6 29  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  1  0  0  0  0
  7 22  1  0  0  0  0
  8  9  1  0  0  0  0
  8 23  1  0  0  0  0
  8 24  1  0  0  0  0
  9 10  1  0  0  0  0
  9 25  1  0  0  0  0
  9 26  1  0  0  0  0
 10 27  1  0  0  0  0
 10 28  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
 13 14  1  0  0  0  0
 13 30  1  0  0  0  0
 13 31  1  0  0  0  0
 14 17  1  0  0  0  0
 14 32  1  0  0  0  0
 14 33  1  0  0  0  0
 15 18  1  0  0  0  0
 15 34  1  0  0  0  0
 16 19  2  0  0  0  0
 16 35  1  0  0  0  0
 17 21  1  0  0  0  0
 17 36  1  0  0  0  0
 17 37  1  0  0  0  0
 18 20  2  0  0  0  0
 18 38  1  0  0  0  0
 19 20  1  0  0  0  0
 19 39  1  0  0  0  0
 20 40  1  0  0  0  0
 21 41  1  0  0  0  0
 21 42  1  0  0  0  0
 21 43  1  0  0  0  0
M  END

$$$$