
 OpenBabel04291915413D

 65 68  0  0  0  0  0  0  0  0999 V2000
    5.3999    9.1680   -2.2237 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6360    7.9882   -1.9370 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3382    8.0362   -1.9486 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6230    6.9317   -1.6801 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2498    5.7776   -1.3997 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5918    5.7280   -1.3876 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2186    4.5739   -1.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5605    4.5244   -1.0951 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1873    3.3703   -0.8147 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2422    6.8721   -1.6657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1801    6.9850   -1.6931 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4803    5.9042   -1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9626    5.9572   -1.4445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6164    4.9476   -1.1991 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6145    7.1571   -1.7373 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6230    6.9319   -1.6790 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2768    7.9416   -1.9244 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1543    4.6636   -1.1276 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4391    3.5591   -0.8592 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0453    2.4432   -0.5869 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3431    2.3955   -0.5742 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0583    3.5000   -0.8426 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4002    3.4507   -0.8295 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1154    4.5552   -1.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4573    4.5059   -1.0849 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4962    4.6142   -1.1145 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2814    1.2634   -0.3001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2245    0.1054   -0.0173 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4151   -1.1447    0.2866 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5382   -2.5236    0.6234 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.5945   -3.9810    0.9776 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6754   -3.9344    0.9652 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2463   -5.1809    1.2704 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9630   -0.0903    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7730   -0.0903    0.0219 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.2817    0.3158   -1.3584 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2817    0.9021    1.0637 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3430   -1.6572    0.4011 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7360    9.9834   -2.4219 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0168    8.9940   -3.0805 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0168    9.4067   -1.3826 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8565    8.9230   -2.1641 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1414    6.5768   -1.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6690    3.7251   -0.9009 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1101    5.3731   -1.3014 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6733    2.4856   -0.5997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4433    7.6731   -1.8637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5921    3.5969   -0.8693 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5766    4.3867   -1.0590 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8819    2.5640   -0.6131 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6337    5.4419   -1.3143 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4888    4.4728   -1.0760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3348    1.0242   -1.1416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3362    1.4377    0.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8407    0.3446    0.8242 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8421   -0.0689   -0.8735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2011   -1.3839   -0.5549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2025   -0.9704    1.1428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1349   -3.0885    0.7588 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2301   -5.2170    1.2800 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7221   -5.9906    1.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063   -0.3750    0.9896 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063   -0.7861   -0.7086 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6063    0.8902   -0.2155 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0196   -1.9153    1.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 39  1  0  0  0  0
  1 40  1  0  0  0  0
  1 41  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3  4  2  0  0  0  0
  3 42  1  0  0  0  0
  4 11  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 43  1  0  0  0  0
  7  8  2  0  0  0  0
  7 44  1  0  0  0  0
  8  9  1  0  0  0  0
  8 45  1  0  0  0  0
  9 10  2  0  0  0  0
  9 46  1  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
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 30 31  1  0  0  0  0
 31 33  1  0  0  0  0
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 34 35  1  0  0  0  0
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 35 38  1  0  0  0  0
 35 37  2  0  0  0  0
 35 36  2  0  0  0  0
 38 65  1  0  0  0  0
M  END
>  <SKU>
A13514

>  <Product Name>
Ro 31-8220

>  <CAS>
138489-18-6

>  <M.Wt>
553.65308

>  <Formula>
C26H27N5O5S2

>  <Synonyms>
BIM IX, Bisindolylmaleimide IX (mesylate)

>  <URL>
https://www.adooq.com/ro-31-8220.html

$$$$
