Anti-TNF ADC 116
     RDKit          2D

 65 71  0  0  1  0  0  0  0  0999 V2000
   -1.7165    3.2962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1785    1.8960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3031    1.6618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2467    2.8278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7087    4.2280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7729    4.4622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7283    2.5937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4097    1.2574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8912    1.4925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1253    2.9742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7886    3.6547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6068    3.2093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2882    1.8730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2279    0.8120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6166   -0.6368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0656   -1.0245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1259    0.0365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7372    1.4853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5750   -0.3512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6353    0.7098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2466    2.1585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7975    2.5463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9637   -1.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4127   -2.1877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4730   -1.1267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0843    0.3220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9220   -1.5145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6570    0.0109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8230   -0.9327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2568   -0.5271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0227   -2.0087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4543   -2.4733    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5147   -1.4122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3192   -8.6031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7812  -10.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8008   -8.3689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3756   -7.4370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3388   -6.9687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8205   -6.7346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3585   -5.3344    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7641   -7.9006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8401   -5.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3781   -3.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8597   -3.4659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3977   -2.0657    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8033   -4.6319    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8793   -1.8315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4174   -0.4313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8229   -2.9975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4738    0.7347    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8990   -0.1972    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0118    2.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0682    3.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4934    2.3691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5866    3.0668    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6062    4.7011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6430    4.2328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1614    3.9986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2178    5.1647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7558    6.5649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2374    6.7990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1810    5.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1981    3.5303    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7362    4.9305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1863    1.0975    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0
  1  2  2  0
  1 63  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  4  7  1  0
  5  6  2  0
  7 11  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  9 14  1  0
  9 28  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 13 18  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 16 32  1  0
 17 18  1  0
 17 19  1  0
 17 65  1  0
 18 22  1  0
 19 20  1  0
 19 23  1  0
 19 33  1  0
 20 21  1  0
 20 26  2  0
 21 22  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 25 27  2  0
 28 29  2  0
 28 30  1  0
 30 31  1  0
 34 35  1  0
 34 36  1  0
 34 37  2  0
 36 38  1  0
 38 39  1  0
 39 40  1  0
 39 41  2  0
 40 42  1  0
 42 43  1  0
 43 44  1  0
 44 45  1  0
 44 46  2  0
 45 47  1  0
 47 48  1  0
 47 49  1  0
 48 50  1  0
 48 51  2  0
 50 52  1  0
 52 53  1  0
 52 54  1  0
 53 55  1  0
 53 56  2  0
 55 57  1  0
 57 62  2  0
 57 58  1  0
 58 59  2  0
 59 60  1  0
 59 64  1  0
 60 61  2  0
 61 62  1  0
 63 64  1  0
M  END
>  <s_m_entry_id>  (1) 
197

>  <s_m_entry_name>  (1) 
ADC_1303-1333.13

>  <s_m_Source_Path>  (1) 
D:\Project\ADC

>  <s_m_Source_File>  (1) 
ADC_1303-1333.sdf

>  <i_m_Source_File_Index>  (1) 
13

>  <i_f3d_flags>  (1) 
0

>  <chiral flag>  (1) 
1

>  <version>  (1) 
0

>  <r_f3d_energy>  (1) 
0

$$$$
