
 OpenBabel04291915433D

 67 67  0  0  0  0  0  0  0  0999 V2000
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   -3.0521    8.3722  -14.3368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0957    7.1652  -13.6549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4442    7.0295  -12.4815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4864    5.8608  -11.8213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8379    5.7257  -10.6531 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4986    6.6242   -8.9770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7535    8.0630  -11.9735 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3739   11.3295  -10.4611 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4161   12.4982  -11.1213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2324   12.6333  -12.2894 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2895    8.9922   -9.1407 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4047   13.9775  -10.3943 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.4609    5.8553  -11.7775 F   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1207   11.8502  -21.6387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5498   10.7805  -22.4909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0943   10.5073  -23.6552 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3182   -0.5809    1.0897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1258   -0.5809    1.0897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7396   -0.0808    0.1515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8003   -1.1305    2.1206 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4192   -0.0456    0.0855 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0330    0.4546   -0.8527 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0937   -0.5952    1.1164 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.9197   12.7820  -19.3148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9721    9.9076  -20.2918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3997   10.4417  -19.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9872   11.5648  -17.7794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5596   11.0307  -18.6338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2107    8.6974  -18.2628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6382    9.2316  -17.4085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2257   10.3547  -15.7505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7982    9.8205  -16.6048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4492    7.4873  -16.2338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8767    8.0214  -15.3795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4642    9.1445  -13.7215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0367    8.6104  -14.5758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0172    5.0665  -12.2117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0611    6.3596   -8.0806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6229    9.0148  -12.3504 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8152   10.3998  -11.8667 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8723   11.2257   -9.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5637   13.1114  -13.1419 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6208    8.5141   -8.2882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0870   12.7814  -22.1647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1361   11.6121  -21.3997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7247   10.2503  -22.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9195   11.0375  -23.9762 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4592    0.3749   -0.7032 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8342   -1.0014    1.8783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7373   -1.1305    2.1206 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0307   -0.5952    1.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  1 39  1  0  0  0  0
  2 26  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 40  1  0  0  0  0
  3 41  1  0  0  0  0
  4  5  1  0  0  0  0
  4 42  1  0  0  0  0
  4 43  1  0  0  0  0
  5  6  1  0  0  0  0
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  5 45  1  0  0  0  0
  6  7  1  0  0  0  0
  6 46  1  0  0  0  0
  6 47  1  0  0  0  0
  7  8  1  0  0  0  0
  7 48  1  0  0  0  0
  7 49  1  0  0  0  0
  8  9  1  0  0  0  0
  8 50  1  0  0  0  0
  8 51  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 15  1  0  0  0  0
 11 12  1  0  0  0  0
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 13 16  1  0  0  0  0
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 20 21  2  0  0  0  0
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 23 58  1  0  0  0  0
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 34 35  2  0  0  0  0
 36 67  1  0  0  0  0
M  END
>  <SKU>
A14321

>  <Product Name>
Ro 48-8071 fumarate

>  <CAS>
189197-69-1

>  <M.Wt>
564.4405432

>  <Formula>
C27H31BrFNO6

>  <Synonyms>
Ro 488071, Ro488071

>  <URL>
https://www.adooq.com/ro-48-8071-fumarate.html

$$$$
