CCOC(=O)c1ccccc1
     RDKit          3D

 21 21  0  0  0  0  0  0  0  0999 V2000
    6.3781   -1.3795   25.0647 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2779   -2.0723   24.0541 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5337   -1.4039   23.9972 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5716   -1.8142   23.1534 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4148   -2.8154   22.4008 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8522   -1.0709   23.1463 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9075   -1.4723   22.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1179   -0.7755   22.3131 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2869    0.3279   23.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2452    0.7375   23.9854 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0327    0.0425   23.9858 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2136   -0.3230   24.7644 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3975   -1.8984   25.1116 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8482   -1.4040   26.0706 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4291   -3.1299   24.3613 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7938   -2.0478   23.0537 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7998   -2.3259   21.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9263   -1.0913   21.6663 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2257    0.8667   23.1533 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3778    1.5937   24.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2396    0.3761   24.6432 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11  6  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
 10 20  1  0
 11 21  1  0
M  END
>  <EmbedRMS>  (1)
0.016243762993699434

>  <Hit>  (1)
1

>  <TETHERED ATOMS>  (1)
4,6,7,8,9,10,11

$$$$
COc1ccc(CCNS(C)(=O)=O)cc1
     RDKit          3D

 29 29  0  0  0  0  0  0  0  0999 V2000
   15.6468    0.7693   22.4057 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4981    1.0647   23.1936 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2995    0.3369   23.1508 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1226   -0.7755   22.3075 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9106   -1.4669   22.3010 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8580   -1.0534   23.1266 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5855   -1.8494   23.1794 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7474   -3.0138   24.1604 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4297   -3.5052   24.5470 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.4630   -4.3499   26.0676 S   0  0  0  0  0  6  0  0  0  0  0  0
    9.8448   -5.4799   26.1663 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1796   -5.1104   26.2026 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5187   -3.3734   27.2038 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0382    0.0458   23.9791 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2493    0.7390   23.9829 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0196   -0.2499   22.6413 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4454    1.5026   22.6399 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3991    0.8459   21.3259 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9170   -1.1160   21.6576 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7953   -2.3308   21.6579 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3289   -2.2403   22.1705 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7483   -1.1923   23.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2948   -2.6558   25.0623 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3297   -3.8334   23.6867 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7602   -6.0885   27.0901 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7964   -4.9103   26.1916 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8389   -6.1503   25.2824 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2444    0.3611   24.6451 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3766    1.5888   24.6415 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 10 13  2  0
  6 14  1  0
 14 15  2  0
 15  3  1  0
  1 16  1  0
  1 17  1  0
  1 18  1  0
  4 19  1  0
  5 20  1  0
  7 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
 11 25  1  0
 11 26  1  0
 11 27  1  0
 14 28  1  0
 15 29  1  0
M  CHG  1   9  -1
M  END
>  <EmbedRMS>  (2)
0.05848793056987064

>  <Hit>  (2)
1

>  <TETHERED ATOMS>  (2)
11,10,12,13,9,8,7,6,5,4,3,15,14

$$$$
COc1ccc(CCNS(C)(=O)=O)cc1
     RDKit          3D

 30 30  0  0  0  0  0  0  0  0999 V2000
   15.6500    0.7745   22.4123 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4994    1.0676   23.1982 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3018    0.3384   23.1523 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1283   -0.7736   22.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9177   -1.4662   22.2978 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8631   -1.0535   23.1196 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5910   -1.8464   23.1603 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7319   -2.9878   24.1788 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4172   -3.5151   24.5492 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4614   -4.3563   26.0703 S   0  0  0  0  0  6  0  0  0  0  0  0
    9.8464   -5.4816   26.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1797   -5.1183   26.2100 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5195   -3.3785   27.2060 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0394    0.0442   23.9752 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2496    0.7385   23.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4472    1.5087   22.6487 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.4044    0.8516   21.3321 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0239   -0.2443   22.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9246   -1.1126   21.6596 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.8051   -2.3292   21.6530 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3593   -2.2665   22.1571 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7534   -1.1682   23.4349 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3491   -3.8030   23.7430 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2490   -2.5997   25.0866 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7470   -2.7249   24.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7689   -6.0877   27.0905 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8374   -6.1545   25.2825 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7962   -4.9087   26.1824 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2427    0.3581   24.6385 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3745    1.5879   24.6427 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 10 13  2  0
  6 14  1  0
 14 15  2  0
 15  3  1  0
  1 16  1  0
  1 17  1  0
  1 18  1  0
  4 19  1  0
  5 20  1  0
  7 21  1  0
  7 22  1  0
  8 23  1  0
  8 24  1  0
  9 25  1  0
 11 26  1  0
 11 27  1  0
 11 28  1  0
 14 29  1  0
 15 30  1  0
M  END
>  <EmbedRMS>  (3)
0.06411415632723867

>  <Hit>  (3)
1

>  <TETHERED ATOMS>  (3)
11,10,12,13,9,8,7,6,5,4,3,15,14

$$$$
COc1ccccc1
     RDKit          3D

 16 16  0  0  0  0  0  0  0  0999 V2000
    9.2910   -2.8601   22.3860 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6156   -1.7239   23.1805 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8519   -1.0617   23.1478 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9053   -1.4711   22.3080 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1176   -0.7769   22.3134 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2888    0.3269   23.1513 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2477    0.7385   23.9863 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0348    0.0453   23.9851 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2525   -3.1766   22.6133 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3566   -2.6033   21.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9784   -3.6998   22.6218 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7975   -2.3221   21.6495 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9254   -1.0945   21.6668 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2285    0.8638   23.1536 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3812    1.5941   24.6356 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2327    0.3699   24.6359 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  3  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  4 12  1  0
  5 13  1  0
  6 14  1  0
  7 15  1  0
  8 16  1  0
M  END
>  <EmbedRMS>  (4)
0.015393883556283685

>  <Hit>  (4)
1

>  <TETHERED ATOMS>  (4)
3,4,5,6,7,8

$$$$
COc1ccc(CCNS(C)(=O)=O)cc1OC
     RDKit          3D

 33 33  0  0  0  0  0  0  0  0999 V2000
   15.6470    0.7548   22.3888 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5036    1.0568   23.1819 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2994    0.3354   23.1490 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1197   -0.7771   22.3073 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9096   -1.4674   22.3010 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8585   -1.0543   23.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5862   -1.8515   23.1772 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7475   -3.0137   24.1608 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4297   -3.5052   24.5470 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.4630   -4.3498   26.0676 S   0  0  0  0  0  6  0  0  0  0  0  0
    9.8448   -5.4798   26.1664 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1796   -5.1103   26.2026 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5187   -3.3733   27.2038 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0365    0.0437   23.9784 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2538    0.7472   23.9888 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4663    1.8570   24.8223 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5010    2.3842   25.7267 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4497    1.4855   22.6173 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0172   -0.2651   22.6253 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3944    0.8302   21.3101 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9125   -1.1193   21.6563 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7943   -2.3314   21.6579 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3320   -2.2449   22.1686 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7470   -1.1951   23.4984 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3309   -3.8339   23.6895 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2936   -2.6536   25.0626 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7602   -6.0883   27.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8389   -6.1503   25.2825 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7964   -4.9102   26.1916 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2275    0.3375   24.6340 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9365    3.2587   26.2520 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2258    1.6174   26.4814 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5986    2.7165   25.1713 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 10 13  2  0
  6 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 15  3  1  0
  1 18  1  0
  1 19  1  0
  1 20  1  0
  4 21  1  0
  5 22  1  0
  7 23  1  0
  7 24  1  0
  8 25  1  0
  8 26  1  0
 11 27  1  0
 11 28  1  0
 11 29  1  0
 14 30  1  0
 17 31  1  0
 17 32  1  0
 17 33  1  0
M  CHG  1   9  -1
M  END
>  <EmbedRMS>  (5)
0.05867780919103782

>  <Hit>  (5)
1

>  <TETHERED ATOMS>  (5)
11,10,12,13,9,8,7,6,5,4,3,15,14

$$$$
COc1ccc(CCNS(C)(=O)=O)cc1OC
     RDKit          3D

 34 34  0  0  0  0  0  0  0  0999 V2000
   15.6504    0.7601   22.3956 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5049    1.0598   23.1866 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3018    0.3370   23.1506 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1254   -0.7752   22.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9167   -1.4667   22.2978 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8636   -1.0544   23.1182 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5917   -1.8486   23.1581 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7320   -2.9878   24.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4172   -3.5149   24.5493 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4614   -4.3561   26.0703 S   0  0  0  0  0  6  0  0  0  0  0  0
    9.8464   -5.4815   26.1645 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1797   -5.1182   26.2100 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5195   -3.3784   27.2061 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0376    0.0421   23.9746 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2541    0.7467   23.9889 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4636    1.8555   24.8244 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4957    2.3803   25.7275 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0215   -0.2596   22.6320 H   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 10 13  2  0
  6 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 15  3  1  0
  1 18  1  0
  1 19  1  0
  1 20  1  0
  4 21  1  0
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  7 23  1  0
  7 24  1  0
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 11 28  1  0
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 11 30  1  0
 14 31  1  0
 17 32  1  0
 17 33  1  0
 17 34  1  0
M  END
>  <EmbedRMS>  (6)
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>  <Hit>  (6)
1

>  <TETHERED ATOMS>  (6)
11,10,12,13,9,8,7,6,5,4,3,15,14

$$$$
COc1ccc(CCNS(C)(=O)=O)c(Cl)c1
     RDKit          3D

 30 30  0  0  0  0  0  0  0  0999 V2000
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   12.3788    1.5872   24.6484 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 10 13  2  0
  6 14  1  0
 14 15  1  0
 14 16  2  0
 16  3  1  0
  1 17  1  0
  1 18  1  0
  1 19  1  0
  4 20  1  0
  5 21  1  0
  7 22  1  0
  7 23  1  0
  8 24  1  0
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 11 27  1  0
 11 28  1  0
 11 29  1  0
 16 30  1  0
M  END
>  <EmbedRMS>  (7)
0.0601537677163591

>  <Hit>  (7)
1

>  <TETHERED ATOMS>  (7)
11,10,12,13,9,8,7,6,5,4,3,16,14

$$$$
COc1ccc(CCNS(C)(=O)=O)c(Cl)c1
     RDKit          3D

 29 29  0  0  0  0  0  0  0  0999 V2000
   14.8717    2.1268   23.9018 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.7958   -4.9097   26.1919 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3788    1.5871   24.6482 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
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  6 14  1  0
 14 15  1  0
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 16  3  1  0
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  8 24  1  0
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 11 26  1  0
 11 27  1  0
 11 28  1  0
 16 29  1  0
M  CHG  1   9  -1
M  END
>  <EmbedRMS>  (8)
0.05979090391071048

>  <Hit>  (8)
1

>  <TETHERED ATOMS>  (8)
11,10,12,13,9,8,7,6,5,4,3,16,14

$$$$
NCCNC(=O)c1ccccc1
     RDKit          3D

 25 25  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12  7  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
  2 17  1  0
  3 18  1  0
  3 19  1  0
  4 20  1  0
  8 21  1  0
  9 22  1  0
 10 23  1  0
 11 24  1  0
 12 25  1  0
M  CHG  1   1   1
M  END
>  <EmbedRMS>  (9)
0.016207616209657

>  <Hit>  (9)
1

>  <TETHERED ATOMS>  (9)
5,7,8,9,10,11,12

$$$$
NCCNC(=O)c1ccccc1
     RDKit          3D

 23 23  0  0  0  0  0  0  0  0999 V2000
    5.7941    0.2299   23.3727 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6535    0.4470   22.2124 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.2543    0.3475   24.6758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
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  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12  7  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  3 17  1  0
  3 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 12 23  1  0
M  CHG  1   4  -1
M  END
>  <EmbedRMS>  (10)
0.015511451944884751

>  <Hit>  (10)
1

>  <TETHERED ATOMS>  (10)
5,7,8,9,10,11,12

$$$$
NCCNC(=O)c1ccccc1
     RDKit          3D

 24 24  0  0  0  0  0  0  0  0999 V2000
    9.2631   -5.6224   23.5320 N   0  0  0  0  0  4  0  0  0  0  0  0
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M  CHG  2   1   1   4  -1
M  END
>  <EmbedRMS>  (11)
0.01607866657479701

>  <Hit>  (11)
1

>  <TETHERED ATOMS>  (11)
5,7,8,9,10,11,12

$$$$
NCCNC(=O)c1ccccc1
     RDKit          3D

 24 24  0  0  0  0  0  0  0  0999 V2000
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 12 24  1  0
M  END
>  <EmbedRMS>  (12)
0.01620257377721421

>  <Hit>  (12)
1

>  <TETHERED ATOMS>  (12)
5,7,8,9,10,11,12

$$$$
CS(=O)(=O)NCCc1ccc(C(=O)O)cc1
     RDKit          3D

 27 27  0  0  0  0  0  0  0  0999 V2000
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 16  8  1  0
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  9 24  1  0
 10 25  1  0
 15 26  1  0
 16 27  1  0
M  CHG  2   5  -1  14  -1
M  END
>  <EmbedRMS>  (13)
0.058548333509641205

>  <Hit>  (13)
1

>  <TETHERED ATOMS>  (13)
1,2,3,4,5,6,7,8,9,10,11,15,16

$$$$
CS(=O)(=O)NCCc1ccc(C(=O)O)cc1
     RDKit          3D

 28 28  0  0  0  0  0  0  0  0999 V2000
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  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
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 10 11  2  0
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 12 13  2  0
 12 14  1  0
 11 15  1  0
 15 16  2  0
 16  8  1  0
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  1 18  1  0
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  6 21  1  0
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  7 23  1  0
  7 24  1  0
  9 25  1  0
 10 26  1  0
 15 27  1  0
 16 28  1  0
M  CHG  1  14  -1
M  END
>  <EmbedRMS>  (14)
0.05891078568463065

>  <Hit>  (14)
1

>  <TETHERED ATOMS>  (14)
1,2,3,4,5,6,7,8,9,10,11,15,16

$$$$
