=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   34.9490  -44.7080   75.3410 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.7180  -44.3220   75.8670 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.5580  -44.5340   75.1370 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.5940  -45.1310   73.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.8490  -45.5070   73.3680 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.0180  -45.3060   74.0850 C   0  0  0  0  0  3  0  0  0  0  0  0
   31.3510  -45.3610   73.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.1650  -44.6760   73.3650 C   0  0  0  0  0  3  0  0  0  0  0  0
   29.0150  -44.8950   72.6160 C   0  0  0  0  0  3  0  0  0  0  0  0
   29.0230  -45.7920   71.5650 C   0  0  0  0  0  3  0  0  0  0  0  0
   30.1860  -46.4820   71.2650 C   0  0  0  0  0  3  0  0  0  0  0  0
   31.3380  -46.2650   72.0130 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.0930  -44.4880   76.0770 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.4340  -44.6680   76.3240 C   0  0  0  0  0  1  0  0  0  0  0  0
   37.3140  -44.2430   75.3870 C   0  0  2  0  0  3  0  0  0  0  0  0
   37.3460  -42.7640   75.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.9770  -41.9410   75.8770 O   0  0  0  0  0  1  0  0  0  0  0  0
   37.7250  -42.4800   73.8630 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  7  8  1  0  0  0  0
  7  4  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
 15 13  1  0  0  0  0
 15 14  1  1  0  0  0
 16 15  1  0  0  0  0
 16 17  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
1

>  <REMARK>
 VINA RESULT:    -6.367      0.000      0.000
 INTER + INTRA:          -8.455
 INTER:                  -7.819
 INTRA:                  -0.635
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-6.367

>  <RMSD_LB>
0.000

>  <RMSD_UB>
0.000

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   32.0130  -45.3210   74.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.9290  -46.0550   73.3740 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.2840  -45.9580   73.6510 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.7600  -45.1300   74.6760 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.8140  -44.4030   75.4120 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.4550  -44.4900   75.1520 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.2170  -45.0200   74.9780 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.0860  -46.1000   74.7920 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.4430  -45.9820   75.0720 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.9620  -44.7880   75.5320 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.1190  -43.7050   75.7240 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.7630  -43.8200   75.4460 C   0  0  0  0  0  3  0  0  0  0  0  0
   30.6700  -45.4250   73.8360 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.0800  -44.0510   72.7610 C   0  0  0  0  0  1  0  0  0  0  0  0
   30.2160  -45.0380   72.5440 C   0  0  2  0  0  3  0  0  0  0  0  0
   29.8020  -46.3050   71.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.6050  -46.7790   70.9730 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.6760  -46.7710   72.0620 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  2  1  2  0  0  0  0
  3  4  2  0  0  0  0
  4  7  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  2  0  0  0  0
  7 12  1  0  0  0  0
  8  7  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 12 11  2  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  1  0  0  0
 15 13  1  0  0  0  0
 16 18  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <MODEL>
2

>  <REMARK>
 VINA RESULT:    -5.833      3.243      7.233
 INTER + INTRA:          -7.796
 INTER:                  -7.263
 INTRA:                  -0.534
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.833

>  <RMSD_LB>
3.243

>  <RMSD_UB>
7.233

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   31.4720  -45.0480   73.6690 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.4490  -45.6890   72.9100 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.7640  -45.7080   73.3520 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.1370  -45.0910   74.5520 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.1320  -44.4530   75.2930 C   0  0  0  0  0  3  0  0  0  0  0  0
   31.8120  -44.4260   74.8690 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.5500  -45.1060   75.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.0870  -44.0380   75.7590 C   0  0  0  0  0  3  0  0  0  0  0  0
   37.4030  -44.0680   76.2050 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.2060  -45.1610   75.9460 C   0  0  0  0  0  3  0  0  0  0  0  0
   37.6950  -46.2290   75.2270 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.3800  -46.2020   74.7790 C   0  0  0  0  0  3  0  0  0  0  0  0
   30.1710  -45.0350   73.2170 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.5090  -43.2950   71.7650 C   0  0  0  0  0  1  0  0  0  0  0  0
   29.9270  -44.7550   71.8430 C   0  0  2  0  0  3  0  0  0  0  0  0
   28.8610  -45.7310   71.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.7970  -46.8450   71.9110 O   0  0  0  0  0  1  0  0  0  0  0  0
   28.1360  -45.3510   70.4150 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  2  1  2  0  0  0  0
  3  4  2  0  0  0  0
  4  7  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12  7  2  0  0  0  0
 12 11  1  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  1  0  0  0
 15 13  1  0  0  0  0
 16 15  1  0  0  0  0
 16 17  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
3

>  <REMARK>
 VINA RESULT:    -5.755      3.616      7.208
 INTER + INTRA:          -7.700
 INTER:                  -7.033
 INTRA:                  -0.667
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.755

>  <RMSD_LB>
3.616

>  <RMSD_UB>
7.208

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   29.8880  -45.4230   72.1370 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.9900  -46.2270   71.8500 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.1430  -46.1140   72.6110 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.2310  -45.2010   73.6700 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.1060  -44.4060   73.9330 C   0  0  0  0  0  3  0  0  0  0  0  0
   29.9430  -44.5070   73.1850 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.4690  -45.0730   74.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7200  -45.4540   73.9940 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.8670  -45.3240   74.7680 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.7950  -44.8060   76.0460 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.5670  -44.4230   76.5600 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.4180  -44.5520   75.7890 C   0  0  0  0  0  3  0  0  0  0  0  0
   28.7500  -45.5440   71.3710 O   0  0  0  0  0  0  0  0  0  0  0  0
   28.2460  -44.2620   69.4530 C   0  0  0  0  0  1  0  0  0  0  0  0
   28.8770  -45.5520   69.9530 C   0  0  2  0  0  3  0  0  0  0  0  0
   28.1970  -46.8160   69.4350 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8390  -47.8830   69.4870 O   0  0  0  0  0  1  0  0  0  0  0  0
   27.0450  -46.6900   68.9770 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  1  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  6  5  2  0  0  0  0
  7 12  1  0  0  0  0
  8  7  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 12 11  2  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  6  0  0  0
 15 13  1  0  0  0  0
 16 17  1  0  0  0  0
 16 15  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
4

>  <REMARK>
 VINA RESULT:    -5.684      4.392      7.779
 INTER + INTRA:          -7.612
 INTER:                  -6.951
 INTRA:                  -0.661
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.684

>  <RMSD_LB>
4.392

>  <RMSD_UB>
7.779

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   35.3500  -45.2210   74.6350 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.3590  -45.4960   73.6940 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.0400  -45.1610   73.9650 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.6770  -44.5500   75.1720 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.6970  -44.2890   76.0980 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.0210  -44.6130   75.8440 C   0  0  0  0  0  3  0  0  0  0  0  0
   31.2600  -44.1890   75.4690 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.7700  -44.1720   76.7790 C   0  0  0  0  0  3  0  0  0  0  0  0
   29.4490  -43.8280   77.0430 C   0  0  0  0  0  3  0  0  0  0  0  0
   28.5950  -43.4870   76.0130 C   0  0  0  0  0  3  0  0  0  0  0  0
   29.0590  -43.4980   74.7080 C   0  0  0  0  0  3  0  0  0  0  0  0
   30.3780  -43.8420   74.4410 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.6550  -45.5620   74.3530 O   0  0  0  0  0  0  0  0  0  0  0  0
   37.7220  -43.9640   72.9810 C   0  0  0  0  0  1  0  0  0  0  0  0
   37.6500  -44.5450   74.3850 C   0  0  2  0  0  3  0  0  0  0  0  0
   38.9520  -45.1860   74.8560 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.1810  -46.3600   74.5030 O   0  0  0  0  0  0  0  0  0  0  0  0
   39.6930  -44.4940   75.5810 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  2  1  2  0  0  0  0
  3  4  2  0  0  0  0
  4  7  1  0  0  0  0
  4  5  1  0  0  0  0
  6  5  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 12  7  2  0  0  0  0
 13 15  1  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  6  0  0  0
 15 16  1  0  0  0  0
 16 18  1  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <MODEL>
5

>  <REMARK>
 VINA RESULT:    -5.628      2.224      3.230
 INTER + INTRA:          -7.543
 INTER:                  -6.906
 INTRA:                  -0.637
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.628

>  <RMSD_LB>
2.224

>  <RMSD_UB>
3.230

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   31.6600  -44.8230   74.3650 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.3900  -44.3780   75.4660 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.7610  -44.5790   75.5110 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.4370  -45.2270   74.4690 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.6750  -45.6640   73.3760 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.3040  -45.4690   73.3120 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.9120  -45.4480   74.5130 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.4660  -46.5580   75.1600 C   0  0  0  0  0  3  0  0  0  0  0  0
   37.8420  -46.7550   75.1880 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.6910  -45.8600   74.5680 C   0  0  0  0  0  3  0  0  0  0  0  0
   38.1640  -44.7530   73.9220 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.7890  -44.5530   73.8930 C   0  0  0  0  0  3  0  0  0  0  0  0
   30.2980  -44.6180   74.3350 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.2160  -42.6480   73.6110 C   0  0  0  0  0  1  0  0  0  0  0  0
   29.7210  -44.0170   73.1810 C   0  0  2  0  0  3  0  0  0  0  0  0
   28.6260  -44.9490   72.6720 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.4430  -44.5820   72.8070 O   0  0  0  0  0  1  0  0  0  0  0  0
   28.9930  -46.0280   72.1680 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  4  7  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  6  1  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 12  7  2  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  1  0  0  0
 15 13  1  0  0  0  0
 16 17  1  0  0  0  0
 16 15  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
6

>  <REMARK>
 VINA RESULT:    -5.608      3.503      6.983
 INTER + INTRA:          -7.518
 INTER:                  -6.888
 INTRA:                  -0.630
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.608

>  <RMSD_LB>
3.503

>  <RMSD_UB>
6.983

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   36.0730  -42.0880   76.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.2330  -40.7130   77.0420 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.6920  -40.0890   78.1560 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.9800  -40.8120   79.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.8350  -42.1930   78.9210 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.3720  -42.8340   77.8150 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.3940  -40.1470   80.3220 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.0390  -40.2790   80.6420 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.5070  -39.6580   81.7670 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.3120  -38.9030   82.5970 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.6570  -38.7590   82.2980 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.1910  -39.3780   81.1750 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.6130  -42.6930   75.7580 O   0  0  0  0  0  0  0  0  0  0  0  0
   38.7030  -43.7850   75.6280 C   0  0  0  0  0  1  0  0  0  0  0  0
   37.2190  -43.9730   75.9010 C   0  0  2  0  0  3  0  0  0  0  0  0
   36.5250  -44.9230   74.9290 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.6700  -46.1480   75.1130 O   0  0  0  0  0  1  0  0  0  0  0  0
   35.8730  -44.4050   74.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  7  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 15  1  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  6  0  0  0
 16 17  1  0  0  0  0
 16 15  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
7

>  <REMARK>
 VINA RESULT:    -5.054      4.903      7.634
 INTER + INTRA:          -6.834
 INTER:                  -6.216
 INTRA:                  -0.618
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.054

>  <RMSD_LB>
4.903

>  <RMSD_UB>
7.634

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   35.0670  -40.4790   79.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.8110  -40.2590   77.8560 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.1340  -41.3250   77.0300 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.7280  -42.6310   77.3350 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.9820  -42.8200   78.5070 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.6480  -41.7650   79.3430 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.0730  -43.7830   76.4520 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.3650  -44.3200   76.4220 C   0  0  0  0  0  3  0  0  0  0  0  0
   37.6720  -45.3970   75.5980 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.7010  -45.9660   74.7980 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.4150  -45.4490   74.8110 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.1060  -44.3720   75.6330 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.7570  -39.4100   79.8260 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.5970  -38.4940   80.0970 C   0  0  0  0  0  1  0  0  0  0  0  0
   33.6020  -39.4920   80.6530 C   0  0  2  0  0  3  0  0  0  0  0  0
   34.0380  -39.1980   82.0850 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1750  -38.7150   82.2580 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.2290  -39.4780   82.9910 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1 13  1  0  0  0  0
  2  1  2  0  0  0  0
  3  4  2  0  0  0  0
  3  2  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  7  4  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10 11  2  0  0  0  0
 10  9  1  0  0  0  0
 11 12  1  0  0  0  0
 12  7  2  0  0  0  0
 13 15  1  0  0  0  0
 15 14  1  6  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <MODEL>
8

>  <REMARK>
 VINA RESULT:    -5.021      4.804      7.233
 INTER + INTRA:          -6.794
 INTER:                  -6.177
 INTRA:                  -0.616
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-5.021

>  <RMSD_LB>
4.804

>  <RMSD_UB>
7.233

$$$$
=
 OpenBabel11082111343D

 18 19  0  0  1  0  0  0  0  0999 V2000
   35.9180  -43.7410   76.7410 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.4970  -42.4730   76.7170 C   0  0  0  0  0  3  0  0  0  0  0  0
   35.9420  -41.4470   77.4660 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.8020  -41.6540   78.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.2420  -42.9390   78.2540 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.7850  -43.9780   77.5140 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.1990  -40.5530   79.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.9130  -40.0720   78.7940 C   0  0  0  0  0  3  0  0  0  0  0  0
   32.3600  -39.0500   79.5580 C   0  0  0  0  0  3  0  0  0  0  0  0
   33.0710  -38.4950   80.6040 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.3470  -38.9560   80.8840 C   0  0  0  0  0  3  0  0  0  0  0  0
   34.9020  -39.9770   80.1220 C   0  0  0  0  0  3  0  0  0  0  0  0
   36.4790  -44.7490   75.9880 O   0  0  0  0  0  0  0  0  0  0  0  0
   35.2510  -45.5320   74.1300 C   0  0  0  0  0  1  0  0  0  0  0  0
   36.4170  -44.6610   74.5700 C   0  0  2  0  0  3  0  0  0  0  0  0
   37.7680  -45.1100   74.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.2270  -46.1950   74.4260 O   0  0  0  0  0  1  0  0  0  0  0  0
   38.3290  -44.3480   73.2080 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  1  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  6  5  2  0  0  0  0
  7 12  1  0  0  0  0
  8  7  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 12 11  2  0  0  0  0
 13  1  1  0  0  0  0
 15 14  1  6  0  0  0
 15 13  1  0  0  0  0
 16 17  1  0  0  0  0
 16 15  1  0  0  0  0
 18 16  2  0  0  0  0
M  END
>  <MODEL>
9

>  <REMARK>
 VINA RESULT:    -4.647      4.130      6.780
 INTER + INTRA:          -6.333
 INTER:                  -5.734
 INTRA:                  -0.599
 UNBOUND:                -0.599
  Name = 
  5 active torsions:
  status: ('A' for Active; 'I' for Inactive)
    1  A    between atoms: C_1  and  C_8
    2  A    between atoms: C_2  and  C_13
    3  A    between atoms: C_8  and  C_9
    4  A    between atoms: C_8  and  O_18
    5  A    between atoms: C_10  and  O_18
                            x       y       z     vdW  Elec       q    Type
                         _______ _______ _______ _____ _____    ______ ____

>  <TORSDO>
F 4

>  <SCORE>
-4.647

>  <RMSD_LB>
4.130

>  <RMSD_UB>
6.780

$$$$
