
     RDKit          3D

 19 20  0  0  0  0  0  0  0  0999 V2000
   25.8690   10.6750   17.9260 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7660   11.4770   18.5500 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1650   12.4880   17.8120 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1480   13.2570   18.3640 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7300   13.0010   19.6620 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6190   13.8450   20.2480 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3280   11.9670   20.4090 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9000   11.7560   21.6900 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.1990   10.4520   22.2010 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3800   10.3250   23.4930 C   0  0  1  0  0  0  0  0  0  0  0  0
   22.7510    9.1510   24.2170 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.5930   11.5910   24.3570 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2540   11.3630   25.7760 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.5710   12.5910   26.5330 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1760   12.4110   28.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7810   12.0710   28.1350 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.5060   10.8660   27.4060 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8170   11.0700   25.9210 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3600   11.2090   19.8480 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  5  1  0
  8  7  1  0
  9  8  1  0
 10  9  1  0
 10 11  1  1
 12 10  1  0
 13 12  1  0
 14 13  1  0
 15 14  1  0
 16 15  1  0
 17 16  1  0
 18 17  1  0
 18 13  1  0
 19  7  2  0
 19  2  1  0
M  END
$$$$

     RDKit          3D

 11 12  0  0  0  0  0  0  0  0999 V2000
   22.8090    9.2070   24.2800 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.4710   10.1080   23.3190 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8900    9.6340   22.1960 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.5680   10.5170   21.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7580   11.8790   21.3690 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3130   12.3920   22.5320 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5210   13.7530   22.7260 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0810   14.2110   23.9020 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4470   13.3190   24.8860 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2450   11.9700   24.7110 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6750   11.4850   23.5440 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  6  2  0
  8  7  1  0
  9  8  2  0
 10  9  1  0
 11  2  1  0
 11 10  2  0
 11  6  1  0
M  END
$$$$

     RDKit          3D

 11 12  0  0  0  0  0  0  0  0999 V2000
   22.7770    9.1670   24.9740 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.4280   10.0140   24.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6770   11.3690   24.2670 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2930   12.2600   23.2950 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6430   11.7880   22.1650 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2220   12.6270   21.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5740   12.1120   20.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3400   10.7540   19.9450 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7580    9.9010   20.9470 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4090   10.3980   22.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7960    9.5320   23.0070 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  6  2  0
  8  7  1  0
  9  8  2  0
 10  9  1  0
 10  5  1  0
 11 10  2  0
 11  2  1  0
M  END
$$$$

     RDKit          3D

 15 16  0  0  0  0  0  0  0  0999 V2000
   22.4510    9.0090   24.4670 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.5180   10.3550   24.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9990   11.2350   24.9790 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.1030   12.5320   24.7160 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7060   13.0330   23.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1940   12.1570   22.5380 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.0810   10.8000   22.8500 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5800    9.9040   21.8960 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.5550   10.3020   20.4800 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9570   10.4800   19.9210 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0930   10.2030   20.6880 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3650   10.3660   20.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5090   10.8070   18.8530 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3830   11.0830   18.0860 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1090   10.9240   18.6170 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  2  1  0
  7  6  2  0
  8  7  1  0
  9  8  1  0
 10  9  1  0
 11 10  2  0
 12 11  1  0
 13 12  2  0
 14 13  1  0
 15 10  1  0
 15 14  2  0
M  END
$$$$

     RDKit          3D

 14 15  0  0  0  0  0  0  0  0999 V2000
   25.2210   12.3240   18.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2950   10.9960   18.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3010   10.4520   19.2480 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2220   11.2280   19.6570 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1370   10.6280   20.5110 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4080   10.7370   21.9940 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4270    9.8630   22.7750 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7420    9.8660   24.2600 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1460    9.4340   24.4920 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.1030   10.3610   23.8220 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8510   10.3500   22.3260 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1570   12.5620   19.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1500   13.1090   18.4810 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.1900   12.8500   17.2940 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0
  3  2  1  0
  4  3  2  0
  5  4  1  0
  6  5  1  0
  7  6  1  0
  8  7  1  0
  9  8  1  0
 10  9  1  0
 11 10  1  0
 11  6  1  0
 12  4  1  0
 13 12  2  0
 13  1  1  0
 14  1  1  0
M  END
$$$$

     RDKit          3D

 18 20  0  0  0  0  0  0  0  0999 V2000
   22.7740    9.2060   24.7160 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.6730   10.1680   23.8290 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6480   11.5040   24.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5410   12.4950   23.2640 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4360   12.1560   21.9280 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4390   10.8180   21.5470 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3390   10.4160   20.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4770    9.5130   19.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8250   10.1870   19.6920 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0890   11.2540   18.8350 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3260   11.8750   18.8250 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.3220   11.4120   19.6750 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6590   11.7950   19.9160 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.1750   10.9440   20.8960 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.2120   10.0690   21.2490 N   0  0  0  0  0  0  0  0  0  0  0  0
   27.0680   10.3360   20.5270 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.8240    9.7170   20.5400 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5470    9.8480   22.5050 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  6  1  0
  8  7  1  0
  9  8  1  0
 10  9  2  0
 11 10  1  0
 12 11  2  0
 13 12  1  0
 14 13  2  0
 15 14  1  0
 16 15  1  0
 16 12  1  0
 17 16  2  0
 17  9  1  0
 18  6  2  0
 18  2  1  0
M  END
$$$$

     RDKit          3D

 21 23  0  0  0  0  0  0  0  0999 V2000
   22.6900    9.3460   24.4820 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.7870   10.6500   24.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0810   11.5110   25.1640 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.1550   12.8130   24.8620 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9370   13.3140   23.5950 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6290   12.4490   22.5700 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5360   11.0880   22.8330 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2030   10.1450   21.8580 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.9100   10.4610   20.4700 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1110   10.8820   19.6530 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9310   11.3890   18.3770 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0150   11.7690   17.6140 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2920   11.6680   18.1200 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5080   11.1670   19.3990 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4040   10.7800   20.1590 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.8870   11.0930   19.9590 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8330   12.0650   19.6660 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0910   11.9730   20.2180 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3740   10.9330   21.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.4890    9.9800   21.3850 N   0  0  0  0  0  0  0  0  0  0  0  0
   27.2660   10.0830   20.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  5  1  0
  7  2  1  0
  7  6  2  0
  8  7  1  0
  9  8  1  0
 10  9  1  0
 11 10  2  0
 12 11  1  0
 13 12  2  0
 14 13  1  0
 15 10  1  0
 15 14  2  0
 16 14  1  0
 17 16  2  0
 18 17  1  0
 19 18  2  0
 20 19  1  0
 21 16  1  0
 21 20  2  0
M  END
$$$$

     RDKit          3D

 20 21  0  0  0  0  0  0  0  0999 V2000
   21.2480   11.2160   24.5450 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1020   11.0880   25.9790 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.1520   11.7400   26.6430 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2750   12.3940   26.0980 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2050   11.6230   28.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1270   12.9990   28.8020 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9520   13.0380   30.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6540   13.4720   29.6460 S   0  0  0  0  0  0  0  0  0  0  0  0
   22.7090   11.4410   24.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8180   11.5780   22.6520 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3510   10.3050   22.0930 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.9200   10.1140   22.3280 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7360    9.9660   23.8360 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5750   10.2440   20.6540 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9890   10.6020   20.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0820    9.9220   20.7960 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3780   10.2710   20.4140 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.5780   11.2950   19.4850 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4840   11.9720   18.9430 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1890   11.6250   19.3240 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  3  2  1  0
  4  3  2  0
  5  3  1  0
  6  5  1  0
  7  6  1  0
  8  7  1  0
  9  1  1  0
 10  9  1  0
 11 10  1  0
 12 11  1  0
 13 12  1  0
 13  1  1  0
 14 11  1  0
 15 14  1  0
 16 15  2  0
 17 16  1  0
 18 17  2  0
 19 18  1  0
 20 15  1  0
 20 19  2  0
M  END
$$$$

     RDKit          3D

 20 21  0  0  0  0  0  0  0  0999 V2000
   23.0110   10.6350   19.8150 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2670   11.1650   19.1280 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.2960   11.1360   20.1630 N   0  0  0  0  0  0  0  0  0  0  0  0
   24.9890   12.0920   21.2290 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7420   11.5350   21.9210 C   0  0  2  0  0  0  0  0  0  0  0  0
   22.6410   11.4290   20.9740 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.6000   11.4040   19.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.7300   10.8900   20.4300 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.6290    9.6500   21.0680 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.6700    9.1850   21.8700 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.8180    9.9600   22.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.9260   11.1970   21.3880 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8800   11.6630   20.5900 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3760   12.3720   23.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0930   12.1770   24.2210 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.4610   13.1780   23.0440 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.8850   12.9460   25.4360 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7100   14.2290   25.4520 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3830   13.8570   26.0370 S   0  0  0  0  0  0  0  0  0  0  0  0
   30.8240    9.5080   22.7950 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  1  0
  4  3  1  0
  5  4  1  0
  6  1  1  0
  6  5  1  0
  7  3  1  0
  8  7  1  0
  9  8  2  0
 10  9  1  0
 11 10  2  0
 12 11  1  0
 13  8  1  0
 13 12  2  0
  5 14  1  1
 15 14  1  0
 16 14  2  0
 17 15  1  0
 18 17  1  0
 19 18  1  0
 20 11  1  0
M  END
$$$$

     RDKit          3D

 10 10  0  0  0  0  0  0  0  0999 V2000
   24.4730   11.1990   19.8620 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.5530   12.0600   20.0930 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9840   11.0460   18.5670 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.8330   10.4330   20.9970 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.1360   12.7690   19.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5550   11.7420   17.5050 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3160   10.6870   21.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6290   12.6010   17.7470 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6740   10.0940   22.2270 N   0  0  0  0  0  0  0  0  0  0  0  0
   26.1850   13.2880   16.6940 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0
  3  1  1  0
  4  1  1  0
  5  2  1  0
  6  3  2  0
  7  4  1  0
  8  6  1  0
  8  5  2  0
  9  7  1  0
 10  8  1  0
M  END
$$$$
