B1RX8A
  -OEChem-04022113003D

 47 48  0     1  0  0  0  0  0999 V2000
   -1.0941    1.1525   -0.6140 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0736    3.0826   -1.1205 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1880    1.8605    0.6163 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1861    0.0996    0.7692 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2079   -0.2514    0.2530 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1491    2.2216    0.0194 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.0015    1.0068   -0.3553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0462   -1.0170    0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7307    1.8545    0.4499 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5621   -0.5988   -0.4535 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1968    0.7565   -0.4075 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9128   -0.9593   -0.2329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5110   -0.5904    0.4369 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7929   -2.1860    1.3484 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8582    0.0461    0.0273 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1494    1.7422   -0.1476 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4775    1.3876    0.0694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3834   -1.6041   -0.7137 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2781   -2.3145   -0.2788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0026   -2.9456   -0.7557 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3255   -3.3002   -0.5387 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2516    0.6390    0.5219 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5633   -0.0823    0.7050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6314    2.7875    0.8254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5468    0.4858   -1.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9658    1.3823   -0.7169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8038   -1.3742   -0.6078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7289    1.2438    1.3596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1909    2.7856    0.6572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2754   -0.2560    1.0581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7876   -0.1892    1.4188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7402    0.1691   -0.3166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1636   -1.4474    0.2356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0106   -1.9161    2.3881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7502   -2.5191    1.2958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4252   -3.0410    1.0855 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8808    2.7948   -0.1333 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1387    2.2197    0.2557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4296   -1.3616   -0.8868 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2936   -2.6617   -0.1192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9802    3.3545   -1.3435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7438   -3.7135   -0.9575 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6204   -4.3451   -0.5716 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4769   -1.2282    0.2205 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8059   -0.6476   -0.1993 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4943   -0.7656    1.5562 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3609    0.6415    0.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 11  1  0  0  0  0
  2  6  1  0  0  0  0
  2 41  1  0  0  0  0
  3 22  2  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4 30  1  0  0  0  0
  5 15  1  0  0  0  0
  5 22  1  0  0  0  0
  5 44  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  6 24  1  0  0  0  0
  7 25  1  0  0  0  0
  7 26  1  0  0  0  0
  8 13  1  0  0  0  0
  8 14  1  0  0  0  0
  8 27  1  0  0  0  0
  9 28  1  0  0  0  0
  9 29  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 18  2  0  0  0  0
 11 16  2  0  0  0  0
 12 15  1  0  0  0  0
 12 19  2  0  0  0  0
 13 31  1  0  0  0  0
 13 32  1  0  0  0  0
 13 33  1  0  0  0  0
 14 34  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 17  2  0  0  0  0
 16 17  1  0  0  0  0
 16 37  1  0  0  0  0
 17 38  1  0  0  0  0
 18 20  1  0  0  0  0
 18 39  1  0  0  0  0
 19 21  1  0  0  0  0
 19 40  1  0  0  0  0
 20 21  2  0  0  0  0
 20 42  1  0  0  0  0
 21 43  1  0  0  0  0
 22 23  1  0  0  0  0
 23 45  1  0  0  0  0
 23 46  1  0  0  0  0
 23 47  1  0  0  0  0
M  END

$$$$