Budesonide derivative P12
                    3D
 Structure written by MMmdl.
 74 79  0  0  1  0            999 V2000
   -4.0932   -6.4148   -1.5957 N   0  0  0  0  0  0
   -3.4021   -5.1345   -1.4738 C   0  0  0  0  0  0
   -3.5634   -4.1618   -2.4534 C   0  0  0  0  0  0
   -2.9055   -2.9431   -2.3374 C   0  0  0  0  0  0
   -2.0864   -2.6970   -1.2419 C   0  0  0  0  0  0
   -1.4332   -1.4868   -1.1268 O   0  0  0  0  0  0
   -0.6478   -1.3529    0.0000 C   0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0
   -0.6550    1.0399   -0.0000 O   0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  1  0  0  0
    2.0007   -1.1471   -0.6623 O   0  0  0  0  0  0
    2.5834   -0.6938   -1.8307 C   0  0  2  0  0  0
    3.6940   -1.6091   -2.2535 C   0  0  0  0  0  0
    3.1457   -2.9854   -2.4883 C   0  0  0  0  0  0
    4.2563   -3.9006   -2.9112 C   0  0  0  0  0  0
    3.0650    0.5785   -1.5977 O   0  0  0  0  0  0
    2.0728    1.1807   -0.7955 C   0  0  2  0  0  0
    2.7037    2.1245    0.2243 C   0  0  0  0  0  0
    3.1512    1.2067    1.3732 C   0  0  2  0  0  0
    2.0930    0.0839    1.4216 C   0  0  2  0  0  0
    2.7633   -1.2181    1.7466 C   0  0  0  0  0  0
    1.0457    0.3498    2.5121 C   0  0  0  0  0  0
    1.6773    0.4550    3.9168 C   0  0  2  0  0  0
    0.8970    1.3096    4.6687 O   0  0  0  0  0  0
    3.1606    0.9218    3.9277 C   0  0  2  0  0  0
    3.9240   -0.1597    3.7574 F   0  0  0  0  0  0
    3.5900    1.5409    5.2829 C   0  0  2  0  0  0
    3.2958    0.6266    6.4672 C   0  0  0  0  0  0
    2.5744    0.9795    7.5466 C   0  0  0  0  0  0
    1.9997    2.3282    7.6600 C   0  0  0  0  0  0
    1.3322    2.6513    8.6385 O   0  0  0  0  0  0
    2.2498    3.2757    6.5622 C   0  0  0  0  0  0
    2.9758    2.9281    5.4780 C   0  0  0  0  0  0
    3.2410    3.8826    4.3249 C   0  0  2  0  0  0
    2.5987    5.0402    4.4806 F   0  0  0  0  0  0
    2.8265    3.2651    2.9800 C   0  0  0  0  0  0
    3.4761    1.8784    2.7458 C   0  0  2  0  0  0
   -1.9252   -3.6697   -0.2624 C   0  0  0  0  0  0
   -2.5830   -4.8884   -0.3783 C   0  0  0  0  0  0
   -3.9730   -7.1391   -0.8661 H   0  0  0  0  0  0
   -4.7033   -6.5982   -2.4114 H   0  0  0  0  0  0
   -4.2011   -4.3534   -3.3063 H   0  0  0  0  0  0
   -3.0311   -2.1858   -3.1000 H   0  0  0  0  0  0
    0.1221   -2.1244    0.0000 H   0  0  0  0  0  0
   -1.2682   -1.4587    0.8900 H   0  0  0  0  0  0
    1.8315   -0.6622   -2.6225 H   0  0  0  0  0  0
    4.4508   -1.6482   -1.4700 H   0  0  0  0  0  0
    4.1427   -1.2349   -3.1737 H   0  0  0  0  0  0
    2.3889   -2.9462   -3.2718 H   0  0  0  0  0  0
    2.6970   -3.3596   -1.5681 H   0  0  0  0  0  0
    3.8579   -4.9008   -3.0818 H   0  0  0  0  0  0
    4.7050   -3.5265   -3.8314 H   0  0  0  0  0  0
    5.0131   -3.9398   -2.1277 H   0  0  0  0  0  0
    1.3237    1.6663   -1.4230 H   0  0  0  0  0  0
    1.9294    2.8167    0.5526 H   0  0  0  0  0  0
    3.5218    2.7094   -0.1969 H   0  0  0  0  0  0
    4.0684    0.7197    1.0347 H   0  0  0  0  0  0
    3.1859   -1.1687    2.7501 H   0  0  0  0  0  0
    2.0319   -2.0249    1.6996 H   0  0  0  0  0  0
    3.5591   -1.4068    1.0261 H   0  0  0  0  0  0
    0.2877   -0.4344    2.5083 H   0  0  0  0  0  0
    0.5191    1.2759    2.2801 H   0  0  0  0  0  0
    1.6108   -0.5124    4.4161 H   0  0  0  0  0  0
    0.4597    0.8920    5.4652 H   0  0  0  0  0  0
    4.6720    1.6804    5.2635 H   0  0  0  0  0  0
    3.7076   -0.3710    6.4099 H   0  0  0  0  0  0
    2.3998    0.2848    8.3547 H   0  0  0  0  0  0
    1.8266    4.2647    6.6580 H   0  0  0  0  0  0
    4.3048    4.1253    4.3126 H   0  0  0  0  0  0
    3.1151    3.9561    2.1878 H   0  0  0  0  0  0
    1.7402    3.1857    2.9435 H   0  0  0  0  0  0
    4.5534    2.0536    2.7485 H   0  0  0  0  0  0
   -1.2875   -3.4781    0.5905 H   0  0  0  0  0  0
   -2.4575   -5.6457    0.3843 H   0  0  0  0  0  0
  1  2  1  0  0  0
  1 40  1  0  0  0
  1 41  1  0  0  0
  2  3  2  0  0  0
  2 39  1  0  0  0
  3  4  1  0  0  0
  3 42  1  0  0  0
  4  5  2  0  0  0
  4 43  1  0  0  0
  5  6  1  0  0  0
  5 38  1  0  0  0
  6  7  1  0  0  0
  7  8  1  0  0  0
  7 44  1  0  0  0
  7 45  1  0  0  0
  8  9  2  0  0  0
  8 10  1  0  0  0
 10 11  1  0  0  0
 10 17  1  0  0  0
 10 20  1  0  0  0
 11 12  1  0  0  0
 12 13  1  0  0  0
 12 16  1  0  0  0
 12 46  1  0  0  0
 13 14  1  0  0  0
 13 47  1  0  0  0
 13 48  1  0  0  0
 14 15  1  0  0  0
 14 49  1  0  0  0
 14 50  1  0  0  0
 15 51  1  0  0  0
 15 52  1  0  0  0
 15 53  1  0  0  0
 16 17  1  0  0  0
 17 18  1  0  0  0
 17 54  1  0  0  0
 18 19  1  0  0  0
 18 55  1  0  0  0
 18 56  1  0  0  0
 19 20  1  0  0  0
 19 37  1  0  0  0
 19 57  1  0  0  0
 20 21  1  0  0  0
 20 22  1  0  0  0
 21 58  1  0  0  0
 21 59  1  0  0  0
 21 60  1  0  0  0
 22 23  1  0  0  0
 22 61  1  0  0  0
 22 62  1  0  0  0
 23 24  1  0  0  0
 23 25  1  0  0  0
 23 63  1  0  0  0
 24 64  1  0  0  0
 25 26  1  0  0  0
 25 27  1  0  0  0
 25 37  1  0  0  0
 27 28  1  0  0  0
 27 33  1  0  0  0
 27 65  1  0  0  0
 28 29  2  0  0  0
 28 66  1  0  0  0
 29 30  1  0  0  0
 29 67  1  0  0  0
 30 31  2  0  0  0
 30 32  1  0  0  0
 32 33  2  0  0  0
 32 68  1  0  0  0
 33 34  1  0  0  0
 34 35  1  0  0  0
 34 36  1  0  0  0
 34 69  1  0  0  0
 36 37  1  0  0  0
 36 70  1  0  0  0
 36 71  1  0  0  0
 37 72  1  0  0  0
 38 39  2  0  0  0
 38 73  1  0  0  0
 39 74  1  0  0  0
M  END
> <s_m_entry_id>
73

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
