# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Thu Oct 13 18:35:05 2022
#   Inital geometry file: a 326 line input string
#   Ligand name: [(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl] dihydrogen phosphate
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CC(C)=CCC\C(C)=C\CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CC\C(C)=C/CO[P](O)(O)=O
#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
_chem_comp.initial_date
_chem_comp.modified_date
_chem_comp.source
 DSL  DSL  "MONO-TRANS, OCTA-CIS DECAPRENYL-PHOSPHATE"  ligand  138  55  .  2022-11-17  2022-11-17
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_DSL
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
_chem_comp_atom.partial_charge
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 DSL  C06   C  CH3   0  -0.748  -13.8882  31.4483  -24.3644
 DSL  C07   C  C     0   0.150  -15.2284  31.8933  -23.8589
 DSL  C08   C  CH3   0  -0.716  -16.3850  31.1805  -24.4940
 DSL  C09   C  C1    0  -0.199  -15.3267  32.8480  -22.9292
 DSL  C10   C  CH2   0  -0.501  -16.5608  33.3814  -22.2748
 DSL  C11   C  CH2   0  -0.478  -16.5102  33.2450  -20.7426
 DSL  C12   C  C     0   0.100  -15.4124  34.0544  -20.1078
 DSL  C13   C  CH3   0  -0.748  -15.5981  35.5432  -20.1575
 DSL  C14   C  C1    0  -0.225  -14.3383  33.4630  -19.5788
 DSL  C15   C  CH2   0  -0.479  -13.1498  34.1579  -18.9794
 DSL  C16   C  CH2   0  -0.497  -12.1979  34.7208  -20.0494
 DSL  C17   C  C     0   0.022  -11.0397  35.4580  -19.4364
 DSL  C18   C  CH3   0  -0.707  -11.3434  36.8506  -18.9651
 DSL  C19   C  C1    0  -0.235   -9.8297  34.9159  -19.2784
 DSL  C20   C  CH2   0  -0.425   -9.4103  33.5446  -19.7263
 DSL  C21   C  CH2   0  -0.570   -7.8906  33.3563  -19.7972
 DSL  C22   C  C     0   0.125   -7.1617  34.3804  -20.6398
 DSL  C23   C  CH3   0  -0.712   -6.3244  35.3721  -19.8834
 DSL  C24   C  C1    0  -0.232   -7.2165  34.4185  -21.9729
 DSL  C25   C  CH2   0  -0.478   -7.9775  33.5149  -22.8917
 DSL  C26   C  CH2   0  -0.501   -8.9729  34.3158  -23.7410
 DSL  C27   C  C     0   0.063   -9.7487  33.5060  -24.7452
 DSL  C28   C  CH3   0  -0.701   -8.9706  32.5038  -25.5495
 DSL  C29   C  C1    0  -0.246  -11.0507  33.6897  -24.9809
 DSL  C30   C  CH2   0  -0.552  -11.9665  34.6911  -24.3380
 DSL  C31   C  CH2   0  -0.482  -11.8175  36.0872  -24.9668
 DSL  C32   C  C     0   0.076  -12.8494  37.0783  -24.5051
 DSL  C33   C  CH3   0  -0.736  -12.8462  37.3707  -23.0314
 DSL  C34   C  C1    0  -0.271  -13.7309  37.6801  -25.3092
 DSL  C35   C  CH2   0  -0.478  -13.9267  37.5077  -26.7819
 DSL  C36   C  CH2   0  -0.508  -15.3500  37.0547  -27.1500
 DSL  C37   C  C     0   0.186  -15.7385  35.7250  -26.5516
 DSL  C38   C  CH3   0  -0.707  -16.5191  35.7867  -25.2717
 DSL  C39   C  C1    0  -0.290  -15.4153  34.5483  -27.0952
 DSL  C40   C  CH2   0  -0.520  -14.6202  34.3058  -28.3404
 DSL  C41   C  CH2   0  -0.459  -13.2205  33.7801  -27.9893
 DSL  C42   C  C     0   0.061  -12.4068  33.3073  -29.1608
 DSL  C43   C  CH3   0  -0.721  -12.2553  34.3001  -30.2775
 DSL  C44   C  C1    0  -0.264  -11.8118  32.1121  -29.2276
 DSL  C45   C  CH2   0  -0.494  -11.8370  31.0004  -28.2268
 DSL  C46   C  CH2   0  -0.508  -12.5001  29.7312  -28.7845
 DSL  C47   C  C     0   0.062  -12.5265  28.6190  -27.7653
 DSL  C48   C  CH3   0  -0.700  -13.8172  28.4609  -27.0179
 DSL  C49   C  C1    0  -0.280  -11.4694  27.8463  -27.5013
 DSL  C50   C  CH2   0  -0.475  -10.1249  27.9254  -28.1521
 DSL  C51   C  CH2   0  -0.495   -9.0268  28.3834  -27.1725
 DSL  C52   C  C     0   0.134   -7.7372  28.6545  -27.8975
 DSL  C53   C  CH3   0  -0.711   -7.6048  30.0396  -28.4547
 DSL  C54   C  C1    0  -0.286   -6.7802  27.7419  -28.0939
 DSL  C55   C  CH2   0  -0.245   -6.8010  26.3385  -27.5839
 DSL  O56   O  O2    0  -0.589   -7.4436  25.4008  -28.4816
 DSL  P57   P  P     0   1.368   -6.9021  25.1920  -29.9649
 DSL  O58   O  O     0  -0.815   -5.4506  25.3868  -30.1540
 DSL  O59   O  OH1   0  -0.537   -7.8667  26.1454  -30.8077
 DSL  O60   O  OH1   0  -0.596   -7.4797  23.7510  -30.3460
 DSL  H061  H  HCH3  0   0.233  -13.7972  31.6277  -25.4392
 DSL  H062  H  HCH3  0   0.242  -13.0646  31.9608  -23.8689
 DSL  H063  H  HCH3  0   0.224  -13.7556  30.3726  -24.2211
 DSL  H081  H  HCH3  0   0.203  -16.3827  31.3480  -25.5747
 DSL  H082  H  HCH3  0   0.227  -16.2968  30.1004  -24.3514
 DSL  H083  H  HCH3  0   0.254  -17.3555  31.4905  -24.1134
 DSL  H09   H  H     0   0.188  -14.3969  33.2867  -22.5737
 DSL  H101  H  HCH2  0   0.216  -16.6883  34.4377  -22.5338
 DSL  H102  H  HCH2  0   0.234  -17.4563  32.8758  -22.6387
 DSL  H111  H  HCH2  0   0.251  -17.4760  33.5673  -20.3392
 DSL  H112  H  HCH2  0   0.214  -16.3964  32.1894  -20.4833
 DSL  H131  H  HCH3  0   0.247  -16.5964  35.8205  -19.8109
 DSL  H132  H  HCH3  0   0.236  -14.8718  36.0859  -19.5543
 DSL  H133  H  HCH3  0   0.219  -15.5105  35.9144  -21.1822
 DSL  H14   H  H     0   0.210  -14.2903  32.3779  -19.6163
 DSL  H151  H  HCH2  0   0.210  -13.4680  34.9710  -18.3217
 DSL  H152  H  HCH2  0   0.281  -12.5972  33.4578  -18.3484
 DSL  H161  H  HCH2  0   0.221  -11.8611  33.9050  -20.6924
 DSL  H162  H  HCH2  0   0.233  -12.7652  35.4034  -20.6885
 DSL  H181  H  HCH3  0   0.267  -12.1797  36.8656  -18.2616
 DSL  H182  H  HCH3  0   0.224  -10.4872  37.3143  -18.4754
 DSL  H183  H  HCH3  0   0.229  -11.6379  37.4864  -19.8050
 DSL  H19   H  H     0   0.232   -9.0763  35.5098  -18.7667
 DSL  H201  H  HCH2  0   0.189   -9.8133  32.7853  -19.0466
 DSL  H202  H  HCH2  0   0.300   -9.8486  33.3212  -20.7020
 DSL  H211  H  HCH2  0   0.249   -7.4882  33.3853  -18.7811
 DSL  H212  H  HCH2  0   0.224   -7.6891  32.3482  -20.1685
 DSL  H231  H  HCH3  0   0.234   -5.5562  34.8648  -19.2939
 DSL  H232  H  HCH3  0   0.197   -5.8275  36.0796  -20.5472
 DSL  H233  H  HCH3  0   0.240   -6.9266  35.9432  -19.1728
 DSL  H24   H  H     0   0.213   -6.6509  35.1999  -22.4776
 DSL  H251  H  HCH2  0   0.230   -7.2651  33.0136  -23.5548
 DSL  H252  H  HCH2  0   0.171   -8.4974  32.7244  -22.3465
 DSL  H261  H  HCH2  0   0.238   -9.6514  34.8566  -23.0769
 DSL  H262  H  HCH2  0   0.257   -8.4082  35.0848  -24.2829
 DSL  H281  H  HCH3  0   0.259   -8.1008  32.9661  -26.0245
 DSL  H282  H  HCH3  0   0.244   -8.5893  31.6869  -24.9322
 DSL  H283  H  HCH3  0   0.171   -9.5848  32.0633  -26.3354
 DSL  H29   H  H     0   0.226  -11.4998  33.0859  -25.7641
 DSL  H301  H  HCH2  0   0.285  -12.9999  34.3576  -24.4668
 DSL  H302  H  HCH2  0   0.275  -11.7956  34.7463  -23.2596
 DSL  H311  H  HCH2  0   0.230  -10.8211  36.4708  -24.7196
 DSL  H312  H  HCH2  0   0.265  -11.8363  35.9816  -26.0518
 DSL  H331  H  HCH3  0   0.257  -13.1895  36.5071  -22.4561
 DSL  H332  H  HCH3  0   0.242  -11.8401  37.6010  -22.6712
 DSL  H333  H  HCH3  0   0.220  -13.4978  38.2077  -22.7812
 DSL  H34   H  H     0   0.236  -14.4155  38.3911  -24.8489
 DSL  H351  H  HCH2  0   0.262  -13.7456  38.4671  -27.2790
 DSL  H352  H  HCH2  0   0.193  -13.2090  36.8049  -27.2061
 DSL  H361  H  HCH2  0   0.213  -16.0594  37.8189  -26.8187
 DSL  H362  H  HCH2  0   0.258  -15.4255  37.0253  -28.2393
 DSL  H381  H  HCH3  0   0.200  -15.9650  36.3214  -24.4961
 DSL  H382  H  HCH3  0   0.226  -17.4585  36.3282  -25.4113
 DSL  H383  H  HCH3  0   0.212  -16.7541  34.7928  -24.8909
 DSL  H39   H  H     0   0.253  -15.7299  33.6467  -26.5720
 DSL  H401  H  HCH2  0   0.222  -15.1328  33.5611  -28.9582
 DSL  H402  H  HCH2  0   0.250  -14.5451  35.2132  -28.9420
 DSL  H411  H  HCH2  0   0.274  -12.6765  34.5871  -27.4877
 DSL  H412  H  HCH2  0   0.200  -13.3319  32.9915  -27.2442
 DSL  H431  H  HCH3  0   0.238  -13.2100  34.5018  -30.7689
 DSL  H432  H  HCH3  0   0.216  -11.8940  35.2603  -29.8994
 DSL  H433  H  HCH3  0   0.217  -11.5583  33.9525  -31.0396
 DSL  H44   H  H     0   0.233  -11.2309  31.8928  -30.1215
 DSL  H451  H  HCH2  0   0.261  -10.8079  30.7545  -27.9463
 DSL  H452  H  HCH2  0   0.235  -12.3383  31.2913  -27.3028
 DSL  H461  H  HCH2  0   0.270  -13.5215  29.9738  -29.0893
 DSL  H462  H  HCH2  0   0.266  -11.9761  29.4250  -29.6933
 DSL  H481  H  HCH3  0   0.242  -13.7592  27.6847  -26.2552
 DSL  H482  H  HCH3  0   0.227  -14.1040  29.3951  -26.5277
 DSL  H483  H  HCH3  0   0.240  -14.6341  28.2087  -27.6988
 DSL  H49   H  H     0   0.205  -11.5680  27.0945  -26.7212
 DSL  H501  H  HCH2  0   0.223   -9.8418  26.9420  -28.5368
 DSL  H502  H  HCH2  0   0.253  -10.1450  28.5952  -29.0139
 DSL  H511  H  HCH2  0   0.206   -9.3545  29.2963  -26.6669
 DSL  H512  H  HCH2  0   0.198   -8.9048  27.6273  -26.3948
 DSL  H531  H  HCH3  0   0.215   -7.5523  30.7715  -27.6449
 DSL  H532  H  HCH3  0   0.263   -6.7166  30.1546  -29.0746
 DSL  H533  H  HCH3  0   0.240   -8.4783  30.3089  -29.0544
 DSL  H54   H  H     0   0.242   -5.9095  28.0260  -28.6773
 DSL  H551  H  HCH2  0   0.198   -5.7848  25.9926  -27.3879
 DSL  H552  H  HCH2  0   0.204   -7.3642  26.2527  -26.6568
 DSL  H60   H  HOH1  0   0.511   -6.9264  23.0133  -30.0560
 DSL  H59   H  HOH1  0   0.458   -7.5796  26.2981  -31.7182

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_neutron
 DSL  C06  C07   single  1.500  0.020  1.500
 DSL  C07  C08   single  1.500  0.020  1.500
 DSL  C07  C09   double  1.336  0.020  1.336
 DSL  C09  C10   single  1.495  0.020  1.495
 DSL  C10  C11   single  1.539  0.020  1.539
 DSL  C11  C12   single  1.504  0.020  1.504
 DSL  C12  C13   single  1.501  0.020  1.501
 DSL  C12  C14   double  1.335  0.020  1.335
 DSL  C14  C15   single  1.502  0.020  1.502
 DSL  C15  C16   single  1.539  0.020  1.539
 DSL  C16  C17   single  1.504  0.020  1.504
 DSL  C17  C18   single  1.501  0.020  1.501
 DSL  C17  C19   double  1.335  0.020  1.335
 DSL  C19  C20   single  1.502  0.020  1.502
 DSL  C20  C21   single  1.533  0.020  1.533
 DSL  C21  C22   single  1.513  0.020  1.513
 DSL  C22  C23   single  1.502  0.020  1.502
 DSL  C22  C24   double  1.335  0.020  1.335
 DSL  C24  C25   single  1.497  0.020  1.497
 DSL  C25  C26   single  1.534  0.020  1.534
 DSL  C26  C27   single  1.505  0.020  1.505
 DSL  C27  C28   single  1.502  0.020  1.502
 DSL  C27  C29   double  1.336  0.020  1.336
 DSL  C29  C30   single  1.502  0.020  1.502
 DSL  C30  C31   single  1.538  0.020  1.538
 DSL  C31  C32   single  1.503  0.020  1.503
 DSL  C32  C33   single  1.502  0.020  1.502
 DSL  C32  C34   double  1.336  0.020  1.336
 DSL  C34  C35   single  1.496  0.020  1.496
 DSL  C35  C36   single  1.538  0.020  1.538
 DSL  C36  C37   single  1.509  0.020  1.509
 DSL  C37  C38   single  1.500  0.020  1.500
 DSL  C37  C39   double  1.336  0.020  1.336
 DSL  C39  C40   single  1.497  0.020  1.497
 DSL  C40  C41   single  1.536  0.020  1.536
 DSL  C41  C42   single  1.503  0.020  1.503
 DSL  C42  C43   single  1.502  0.020  1.502
 DSL  C42  C44   double  1.337  0.020  1.337
 DSL  C44  C45   single  1.496  0.020  1.496
 DSL  C45  C46   single  1.537  0.020  1.537
 DSL  C46  C47   single  1.509  0.020  1.509
 DSL  C47  C48   single  1.500  0.020  1.500
 DSL  C47  C49   double  1.336  0.020  1.336
 DSL  C49  C50   single  1.496  0.020  1.496
 DSL  C50  C51   single  1.541  0.020  1.541
 DSL  C51  C52   single  1.504  0.020  1.504
 DSL  C52  C53   single  1.499  0.020  1.499
 DSL  C52  C54   double  1.337  0.020  1.337
 DSL  C54  C55   single  1.493  0.020  1.493
 DSL  C55  O56   single  1.449  0.020  1.449
 DSL  O56  P57   single  1.593  0.020  1.593
 DSL  P57  O58   double  1.477  0.020  1.477
 DSL  P57  O59   single  1.597  0.020  1.597
 DSL  P57  O60   single  1.599  0.020  1.599
 DSL  C06  H061  single  0.970  0.020  1.090
 DSL  C06  H062  single  0.970  0.020  1.090
 DSL  C06  H063  single  0.970  0.020  1.090
 DSL  C08  H081  single  0.970  0.020  1.090
 DSL  C08  H082  single  0.970  0.020  1.090
 DSL  C08  H083  single  0.970  0.020  1.090
 DSL  C09  H09   single  0.930  0.020  1.080
 DSL  C10  H101  single  0.970  0.020  1.090
 DSL  C10  H102  single  0.970  0.020  1.090
 DSL  C11  H111  single  0.970  0.020  1.090
 DSL  C11  H112  single  0.970  0.020  1.090
 DSL  C13  H131  single  0.970  0.020  1.090
 DSL  C13  H132  single  0.970  0.020  1.090
 DSL  C13  H133  single  0.970  0.020  1.090
 DSL  C14  H14   single  0.930  0.020  1.080
 DSL  C15  H151  single  0.970  0.020  1.090
 DSL  C15  H152  single  0.970  0.020  1.090
 DSL  C16  H161  single  0.970  0.020  1.090
 DSL  C16  H162  single  0.970  0.020  1.090
 DSL  C18  H181  single  0.970  0.020  1.090
 DSL  C18  H182  single  0.970  0.020  1.090
 DSL  C18  H183  single  0.970  0.020  1.090
 DSL  C19  H19   single  0.930  0.020  1.080
 DSL  C20  H201  single  0.970  0.020  1.090
 DSL  C20  H202  single  0.970  0.020  1.090
 DSL  C21  H211  single  0.970  0.020  1.090
 DSL  C21  H212  single  0.970  0.020  1.090
 DSL  C23  H231  single  0.970  0.020  1.090
 DSL  C23  H232  single  0.970  0.020  1.090
 DSL  C23  H233  single  0.970  0.020  1.090
 DSL  C24  H24   single  0.930  0.020  1.080
 DSL  C25  H251  single  0.970  0.020  1.090
 DSL  C25  H252  single  0.970  0.020  1.090
 DSL  C26  H261  single  0.970  0.020  1.090
 DSL  C26  H262  single  0.970  0.020  1.090
 DSL  C28  H281  single  0.970  0.020  1.090
 DSL  C28  H282  single  0.970  0.020  1.090
 DSL  C28  H283  single  0.970  0.020  1.090
 DSL  C29  H29   single  0.930  0.020  1.080
 DSL  C30  H301  single  0.970  0.020  1.090
 DSL  C30  H302  single  0.970  0.020  1.090
 DSL  C31  H311  single  0.970  0.020  1.090
 DSL  C31  H312  single  0.970  0.020  1.090
 DSL  C33  H331  single  0.970  0.020  1.090
 DSL  C33  H332  single  0.970  0.020  1.090
 DSL  C33  H333  single  0.970  0.020  1.090
 DSL  C34  H34   single  0.930  0.020  1.080
 DSL  C35  H351  single  0.970  0.020  1.090
 DSL  C35  H352  single  0.970  0.020  1.090
 DSL  C36  H361  single  0.970  0.020  1.090
 DSL  C36  H362  single  0.970  0.020  1.090
 DSL  C38  H381  single  0.970  0.020  1.090
 DSL  C38  H382  single  0.970  0.020  1.090
 DSL  C38  H383  single  0.970  0.020  1.090
 DSL  C39  H39   single  0.930  0.020  1.080
 DSL  C40  H401  single  0.970  0.020  1.090
 DSL  C40  H402  single  0.970  0.020  1.090
 DSL  C41  H411  single  0.970  0.020  1.090
 DSL  C41  H412  single  0.970  0.020  1.090
 DSL  C43  H431  single  0.970  0.020  1.090
 DSL  C43  H432  single  0.970  0.020  1.090
 DSL  C43  H433  single  0.970  0.020  1.090
 DSL  C44  H44   single  0.930  0.020  1.080
 DSL  C45  H451  single  0.970  0.020  1.090
 DSL  C45  H452  single  0.970  0.020  1.090
 DSL  C46  H461  single  0.970  0.020  1.090
 DSL  C46  H462  single  0.970  0.020  1.090
 DSL  C48  H481  single  0.970  0.020  1.090
 DSL  C48  H482  single  0.970  0.020  1.090
 DSL  C48  H483  single  0.970  0.020  1.090
 DSL  C49  H49   single  0.930  0.020  1.080
 DSL  C50  H501  single  0.970  0.020  1.090
 DSL  C50  H502  single  0.970  0.020  1.090
 DSL  C51  H511  single  0.970  0.020  1.090
 DSL  C51  H512  single  0.970  0.020  1.090
 DSL  C53  H531  single  0.970  0.020  1.090
 DSL  C53  H532  single  0.970  0.020  1.090
 DSL  C53  H533  single  0.970  0.020  1.090
 DSL  C54  H54   single  0.930  0.020  1.080
 DSL  C55  H551  single  0.970  0.020  1.090
 DSL  C55  H552  single  0.970  0.020  1.090
 DSL  O60  H60   single  0.850  0.020  0.980
 DSL  O59  H59   single  0.850  0.020  0.980

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 DSL  H063  C06  H062  108.15  3.000
 DSL  H063  C06  H061  106.27  3.000
 DSL  H062  C06  H061  107.88  3.000
 DSL  H063  C06  C07   110.86  3.000
 DSL  H062  C06  C07   112.51  3.000
 DSL  H061  C06  C07   110.92  3.000
 DSL  C09   C07  C08   125.28  3.000
 DSL  C09   C07  C06   120.81  3.000
 DSL  C08   C07  C06   113.92  3.000
 DSL  H083  C08  H082  107.94  3.000
 DSL  H083  C08  H081  107.70  3.000
 DSL  H082  C08  H081  106.27  3.000
 DSL  H083  C08  C07   113.86  3.000
 DSL  H082  C08  C07   110.62  3.000
 DSL  H081  C08  C07   110.13  3.000
 DSL  H09   C09  C10   114.75  3.000
 DSL  H09   C09  C07   116.91  3.000
 DSL  C10   C09  C07   128.32  3.000
 DSL  H102  C10  H101  105.82  3.000
 DSL  H102  C10  C11   108.54  3.000
 DSL  H101  C10  C11   108.95  3.000
 DSL  H102  C10  C09   111.49  3.000
 DSL  H101  C10  C09   109.67  3.000
 DSL  C11   C10  C09   112.14  3.000
 DSL  H112  C11  H111  106.78  3.000
 DSL  H112  C11  C12   110.09  3.000
 DSL  H111  C11  C12   109.26  3.000
 DSL  H112  C11  C10   108.98  3.000
 DSL  H111  C11  C10   108.16  3.000
 DSL  C12   C11  C10   113.35  3.000
 DSL  C14   C12  C13   123.49  3.000
 DSL  C14   C12  C11   121.05  3.000
 DSL  C13   C12  C11   115.43  3.000
 DSL  H133  C13  H132  107.25  3.000
 DSL  H133  C13  H131  106.51  3.000
 DSL  H132  C13  H131  107.89  3.000
 DSL  H133  C13  C12   110.97  3.000
 DSL  H132  C13  C12   113.17  3.000
 DSL  H131  C13  C12   110.75  3.000
 DSL  H14   C14  C15   116.16  3.000
 DSL  H14   C14  C12   117.64  3.000
 DSL  C15   C14  C12   126.15  3.000
 DSL  H152  C15  H151  106.04  3.000
 DSL  H152  C15  C16   108.86  3.000
 DSL  H151  C15  C16   109.05  3.000
 DSL  H152  C15  C14   109.53  3.000
 DSL  H151  C15  C14   110.73  3.000
 DSL  C16   C15  C14   112.42  3.000
 DSL  H162  C16  H161  106.39  3.000
 DSL  H162  C16  C17   109.38  3.000
 DSL  H161  C16  C17   111.64  3.000
 DSL  H162  C16  C15   108.29  3.000
 DSL  H161  C16  C15   109.08  3.000
 DSL  C17   C16  C15   111.86  3.000
 DSL  C19   C17  C18   121.52  3.000
 DSL  C19   C17  C16   123.18  3.000
 DSL  C18   C17  C16   115.27  3.000
 DSL  H183  C18  H182  108.02  3.000
 DSL  H183  C18  H181  106.28  3.000
 DSL  H182  C18  H181  107.82  3.000
 DSL  H183  C18  C17   110.65  3.000
 DSL  H182  C18  C17   112.13  3.000
 DSL  H181  C18  C17   111.69  3.000
 DSL  H19   C19  C20   116.45  3.000
 DSL  H19   C19  C17   117.51  3.000
 DSL  C20   C19  C17   126.03  3.000
 DSL  H202  C20  H201  105.35  3.000
 DSL  H202  C20  C21   109.35  3.000
 DSL  H201  C20  C21   107.95  3.000
 DSL  H202  C20  C19   109.93  3.000
 DSL  H201  C20  C19   110.17  3.000
 DSL  C21   C20  C19   113.74  3.000
 DSL  H212  C21  H211  105.80  3.000
 DSL  H212  C21  C22   110.25  3.000
 DSL  H211  C21  C22   108.80  3.000
 DSL  H212  C21  C20   108.17  3.000
 DSL  H211  C21  C20   108.59  3.000
 DSL  C22   C21  C20   114.85  3.000
 DSL  C24   C22  C23   120.46  3.000
 DSL  C24   C22  C21   123.76  3.000
 DSL  C23   C22  C21   115.78  3.000
 DSL  H233  C23  H232  107.94  3.000
 DSL  H233  C23  H231  106.21  3.000
 DSL  H232  C23  H231  108.01  3.000
 DSL  H233  C23  C22   111.43  3.000
 DSL  H232  C23  C22   112.09  3.000
 DSL  H231  C23  C22   110.91  3.000
 DSL  H24   C24  C25   114.39  3.000
 DSL  H24   C24  C22   117.52  3.000
 DSL  C25   C24  C22   128.08  3.000
 DSL  H252  C25  H251  106.31  3.000
 DSL  H252  C25  C26   110.20  3.000
 DSL  H251  C25  C26   109.02  3.000
 DSL  H252  C25  C24   111.88  3.000
 DSL  H251  C25  C24   108.51  3.000
 DSL  C26   C25  C24   110.77  3.000
 DSL  H262  C26  H261  105.83  3.000
 DSL  H262  C26  C27   108.22  3.000
 DSL  H261  C26  C27   110.59  3.000
 DSL  H262  C26  C25   107.78  3.000
 DSL  H261  C26  C25   108.96  3.000
 DSL  C27   C26  C25   115.02  3.000
 DSL  C29   C27  C28   120.14  3.000
 DSL  C29   C27  C26   123.10  3.000
 DSL  C28   C27  C26   116.68  3.000
 DSL  H283  C28  H282  107.56  3.000
 DSL  H283  C28  H281  107.80  3.000
 DSL  H282  C28  H281  106.50  3.000
 DSL  H283  C28  C27   111.32  3.000
 DSL  H282  C28  C27   112.15  3.000
 DSL  H281  C28  C27   111.25  3.000
 DSL  H29   C29  C30   115.30  3.000
 DSL  H29   C29  C27   116.99  3.000
 DSL  C30   C29  C27   127.63  3.000
 DSL  H302  C30  H301  106.22  3.000
 DSL  H302  C30  C31   110.01  3.000
 DSL  H301  C30  C31   108.67  3.000
 DSL  H302  C30  C29   111.14  3.000
 DSL  H301  C30  C29   108.82  3.000
 DSL  C31   C30  C29   111.78  3.000
 DSL  H312  C31  H311  105.91  3.000
 DSL  H312  C31  C32   110.96  3.000
 DSL  H311  C31  C32   108.90  3.000
 DSL  H312  C31  C30   108.50  3.000
 DSL  H311  C31  C30   108.26  3.000
 DSL  C32   C31  C30   113.97  3.000
 DSL  C34   C32  C33   120.26  3.000
 DSL  C34   C32  C31   124.39  3.000
 DSL  C33   C32  C31   115.35  3.000
 DSL  H333  C33  H332  108.22  3.000
 DSL  H333  C33  H331  107.35  3.000
 DSL  H332  C33  H331  106.39  3.000
 DSL  H333  C33  C32   111.92  3.000
 DSL  H332  C33  C32   111.48  3.000
 DSL  H331  C33  C32   111.22  3.000
 DSL  H34   C34  C35   114.15  3.000
 DSL  H34   C34  C32   117.03  3.000
 DSL  C35   C34  C32   128.82  3.000
 DSL  H352  C35  H351  106.20  3.000
 DSL  H352  C35  C36   109.03  3.000
 DSL  H351  C35  C36   107.59  3.000
 DSL  H352  C35  C34   111.79  3.000
 DSL  H351  C35  C34   108.92  3.000
 DSL  C36   C35  C34   113.00  3.000
 DSL  H362  C36  H361  106.02  3.000
 DSL  H362  C36  C37   110.73  3.000
 DSL  H361  C36  C37   109.18  3.000
 DSL  H362  C36  C35   108.09  3.000
 DSL  H361  C36  C35   108.77  3.000
 DSL  C37   C36  C35   113.76  3.000
 DSL  C39   C37  C38   120.61  3.000
 DSL  C39   C37  C36   123.54  3.000
 DSL  C38   C37  C36   115.85  3.000
 DSL  H383  C38  H382  108.12  3.000
 DSL  H383  C38  H381  107.91  3.000
 DSL  H382  C38  H381  106.49  3.000
 DSL  H383  C38  C37   111.89  3.000
 DSL  H382  C38  C37   111.01  3.000
 DSL  H381  C38  C37   111.20  3.000
 DSL  H39   C39  C40   114.77  3.000
 DSL  H39   C39  C37   117.64  3.000
 DSL  C40   C39  C37   127.56  3.000
 DSL  H402  C40  H401  106.66  3.000
 DSL  H402  C40  C41   110.36  3.000
 DSL  H401  C40  C41   108.84  3.000
 DSL  H402  C40  C39   111.12  3.000
 DSL  H401  C40  C39   109.32  3.000
 DSL  C41   C40  C39   110.44  3.000
 DSL  H412  C41  H411  105.70  3.000
 DSL  H412  C41  C42   111.13  3.000
 DSL  H411  C41  C42   108.67  3.000
 DSL  H412  C41  C40   108.10  3.000
 DSL  H411  C41  C40   107.77  3.000
 DSL  C42   C41  C40   115.02  3.000
 DSL  C44   C42  C43   120.59  3.000
 DSL  C44   C42  C41   124.15  3.000
 DSL  C43   C42  C41   115.23  3.000
 DSL  H433  C43  H432  108.09  3.000
 DSL  H433  C43  H431  107.65  3.000
 DSL  H432  C43  H431  106.39  3.000
 DSL  H433  C43  C42   111.94  3.000
 DSL  H432  C43  C42   110.91  3.000
 DSL  H431  C43  C42   111.61  3.000
 DSL  H44   C44  C45   114.13  3.000
 DSL  H44   C44  C42   117.31  3.000
 DSL  C45   C44  C42   128.57  3.000
 DSL  H452  C45  H451  105.95  3.000
 DSL  H452  C45  C46   109.23  3.000
 DSL  H451  C45  C46   108.24  3.000
 DSL  H452  C45  C44   112.11  3.000
 DSL  H451  C45  C44   108.82  3.000
 DSL  C46   C45  C44   112.22  3.000
 DSL  H462  C46  H461  106.17  3.000
 DSL  H462  C46  C47   111.32  3.000
 DSL  H461  C46  C47   109.61  3.000
 DSL  H462  C46  C45   109.04  3.000
 DSL  H461  C46  C45   108.72  3.000
 DSL  C47   C46  C45   111.79  3.000
 DSL  C49   C47  C48   121.44  3.000
 DSL  C49   C47  C46   123.10  3.000
 DSL  C48   C47  C46   115.43  3.000
 DSL  H483  C48  H482  106.29  3.000
 DSL  H483  C48  H481  108.14  3.000
 DSL  H482  C48  H481  107.98  3.000
 DSL  H483  C48  C47   110.92  3.000
 DSL  H482  C48  C47   111.05  3.000
 DSL  H481  C48  C47   112.21  3.000
 DSL  H49   C49  C50   115.47  3.000
 DSL  H49   C49  C47   118.02  3.000
 DSL  C50   C49  C47   126.50  3.000
 DSL  H502  C50  H501  106.19  3.000
 DSL  H502  C50  C51   109.43  3.000
 DSL  H501  C50  C51   107.85  3.000
 DSL  H502  C50  C49   111.06  3.000
 DSL  H501  C50  C49   109.77  3.000
 DSL  C51   C50  C49   112.31  3.000
 DSL  H512  C51  H511  106.40  3.000
 DSL  H512  C51  C52   111.87  3.000
 DSL  H511  C51  C52   109.22  3.000
 DSL  H512  C51  C50   109.07  3.000
 DSL  H511  C51  C50   109.17  3.000
 DSL  C52   C51  C50   110.98  3.000
 DSL  C54   C52  C53   120.86  3.000
 DSL  C54   C52  C51   124.16  3.000
 DSL  C53   C52  C51   114.93  3.000
 DSL  H533  C53  H532  108.26  3.000
 DSL  H533  C53  H531  106.25  3.000
 DSL  H532  C53  H531  108.18  3.000
 DSL  H533  C53  C52   111.16  3.000
 DSL  H532  C53  C52   112.41  3.000
 DSL  H531  C53  C52   110.34  3.000
 DSL  H54   C54  C55   116.14  3.000
 DSL  H54   C54  C52   118.32  3.000
 DSL  C55   C54  C52   125.55  3.000
 DSL  H552  C55  H551  107.70  3.000
 DSL  H552  C55  O56   104.32  3.000
 DSL  H551  C55  O56   108.62  3.000
 DSL  H552  C55  C54   111.86  3.000
 DSL  H551  C55  C54   110.26  3.000
 DSL  O56   C55  C54   113.76  3.000
 DSL  P57   O56  C55   120.74  3.000
 DSL  O60   P57  O59   101.19  3.000
 DSL  O60   P57  O58   116.34  3.000
 DSL  O59   P57  O58   116.58  3.000
 DSL  O60   P57  O56   102.55  3.000
 DSL  O59   P57  O56   101.99  3.000
 DSL  O58   P57  O56   115.86  3.000
 DSL  H59   O59  P57   114.32  3.000
 DSL  H60   O60  P57   114.18  3.000

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 DSL  Var_01   C10   C09  C07  C06  -177.57   0.0  2
 DSL  Var_02   C10   C09  C07  C08     2.74   0.0  2
 DSL  Var_03   C15   C14  C12  C11   176.84   0.0  2
 DSL  Var_04   C15   C14  C12  C13    -1.12   0.0  2
 DSL  Var_05   C20   C19  C17  C16     2.89   0.0  2
 DSL  Var_06   C20   C19  C17  C18  -179.10   0.0  2
 DSL  Var_07   C25   C24  C22  C21     0.50   0.0  2
 DSL  Var_08   C25   C24  C22  C23   179.37   0.0  2
 DSL  Var_09   C30   C29  C27  C26     0.37   0.0  2
 DSL  Var_10   C30   C29  C27  C28  -176.29   0.0  2
 DSL  Var_11   C35   C34  C32  C31     1.52   0.0  2
 DSL  Var_12   C35   C34  C32  C33  -178.27   0.0  2
 DSL  Var_13   C40   C39  C37  C36     0.99   0.0  2
 DSL  Var_14   C40   C39  C37  C38  -178.48   0.0  2
 DSL  Var_15   C45   C44  C42  C41     1.68   0.0  2
 DSL  Var_16   C45   C44  C42  C43   179.72   0.0  2
 DSL  Var_17   C50   C49  C47  C46    -0.80   0.0  2
 DSL  Var_18   C50   C49  C47  C48  -178.55   0.0  2
 DSL  Var_19   C55   C54  C52  C51    -2.83   0.0  2
 DSL  Var_20   C55   C54  C52  C53   179.74   0.0  2
 DSL  Var_21   C11   C10  C09  C07   122.76  30.0  3
 DSL  Var_22   C12   C11  C10  C09    63.82  30.0  3
 DSL  Var_23   C13   C12  C11  C10    69.15  30.0  3
 DSL  Var_24   C14   C12  C11  C10  -108.97  30.0  3
 DSL  Var_25   C16   C15  C14  C12   -77.24  30.0  3
 DSL  Var_26   C17   C16  C15  C14   177.87  30.0  3
 DSL  Var_27   C18   C17  C16  C15   -78.79  30.0  3
 DSL  Var_28   C19   C17  C16  C15    99.33  30.0  3
 DSL  Var_29   C21   C20  C19  C17   162.48  30.0  3
 DSL  Var_30   C22   C21  C20  C19   -54.16  30.0  3
 DSL  Var_31   C23   C22  C21  C20   108.96  30.0  3
 DSL  Var_32   C24   C22  C21  C20   -72.13  30.0  3
 DSL  Var_33   C26   C25  C24  C22   120.70  30.0  3
 DSL  Var_34   C27   C26  C25  C24   177.42  30.0  3
 DSL  Var_35   C28   C27  C26  C25   -44.46  30.0  3
 DSL  Var_36   C29   C27  C26  C25   138.77  30.0  3
 DSL  Var_37   C31   C30  C29  C27    80.29  30.0  3
 DSL  Var_38   C32   C31  C30  C29   171.40  30.0  3
 DSL  Var_39   C33   C32  C31  C30    61.18  30.0  3
 DSL  Var_40   C34   C32  C31  C30  -118.63  30.0  3
 DSL  Var_41   C36   C35  C34  C32   121.69  30.0  3
 DSL  Var_42   C37   C36  C35  C34   -60.68  30.0  3
 DSL  Var_43   C38   C37  C36  C35    96.24  30.0  3
 DSL  Var_44   C39   C37  C36  C35   -83.25  30.0  3
 DSL  Var_45   C41   C40  C39  C37   106.91  30.0  3
 DSL  Var_46   C42   C41  C40  C39   171.25  30.0  3
 DSL  Var_47   C43   C42  C41  C40    53.76  30.0  3
 DSL  Var_48   C44   C42  C41  C40  -128.11  30.0  3
 DSL  Var_49   C46   C45  C44  C42   117.01  30.0  3
 DSL  Var_50   C47   C46  C45  C44  -179.71  30.0  3
 DSL  Var_51   C48   C47  C46  C45    98.10  30.0  3
 DSL  Var_52   C49   C47  C46  C45   -79.78  30.0  3
 DSL  Var_53   C51   C50  C49  C47   113.10  30.0  3
 DSL  Var_54   C52   C51  C50  C49  -171.36  30.0  3
 DSL  Var_55   C53   C52  C51  C50    86.63  30.0  3
 DSL  Var_56   C54   C52  C51  C50   -90.94  30.0  3
 DSL  Var_57   O56   C55  C54  C52    88.56  30.0  3
 DSL  Var_58   P57   O56  C55  C54    58.97  30.0  3
 DSL  Var_59   O58   P57  O56  C55    30.69  30.0  3
 DSL  Var_60   O59   P57  O56  C55   -96.99  30.0  3
 DSL  Var_61   O60   P57  O56  C55   158.49  30.0  3
 DSL  Var_62   H09   C09  C07  C06     0.74   0.0  2
 DSL  Var_63   H09   C09  C07  C08  -178.94   0.0  2
 DSL  Var_64   H14   C14  C12  C11    -0.48   0.0  2
 DSL  Var_65   H14   C14  C12  C13  -178.45   0.0  2
 DSL  Var_66   H19   C19  C17  C16  -176.18   0.0  2
 DSL  Var_67   H19   C19  C17  C18     1.83   0.0  2
 DSL  Var_68   H24   C24  C22  C21  -179.97   0.0  2
 DSL  Var_69   H24   C24  C22  C23    -1.10   0.0  2
 DSL  Var_70   H29   C29  C27  C26   176.84   0.0  2
 DSL  Var_71   H29   C29  C27  C28     0.18   0.0  2
 DSL  Var_72   H34   C34  C32  C31  -179.03   0.0  2
 DSL  Var_73   H34   C34  C32  C33     1.17   0.0  2
 DSL  Var_74   H39   C39  C37  C36   178.90   0.0  2
 DSL  Var_75   H39   C39  C37  C38    -0.57   0.0  2
 DSL  Var_76   H44   C44  C42  C41  -178.71   0.0  2
 DSL  Var_77   H44   C44  C42  C43    -0.67   0.0  2
 DSL  Var_78   H49   C49  C47  C46   177.55   0.0  2
 DSL  Var_79   H49   C49  C47  C48    -0.20   0.0  2
 DSL  Var_80   H54   C54  C52  C51   176.74   0.0  2
 DSL  Var_81   H54   C54  C52  C53    -0.70   0.0  2
 DSL  Var_82   H081  C08  C07  C06   -60.02  30.0  3
 DSL  Var_83   H082  C08  C07  C06    57.15  30.0  3
 DSL  Var_84   H083  C08  C07  C06   178.91  30.0  3
 DSL  Var_85   H101  C10  C09  C07  -116.05  30.0  3
 DSL  Var_86   H102  C10  C09  C07     0.81  30.0  3
 DSL  Var_87   H061  C06  C07  C08    60.63  30.0  3
 DSL  Var_88   H062  C06  C07  C08  -178.43  30.0  3
 DSL  Var_89   H063  C06  C07  C08   -57.18  30.0  3
 DSL  Var_90   H061  C06  C07  C09  -119.09  30.0  3
 DSL  Var_91   H062  C06  C07  C09     1.85  30.0  3
 DSL  Var_92   H063  C06  C07  C09   123.10  30.0  3
 DSL  Var_93   H081  C08  C07  C09   119.68  30.0  3
 DSL  Var_94   H082  C08  C07  C09  -123.15  30.0  3
 DSL  Var_95   H083  C08  C07  C09    -1.39  30.0  3
 DSL  Var_96   H111  C11  C10  C09  -174.87  30.0  3
 DSL  Var_97   H112  C11  C10  C09   -59.15  30.0  3
 DSL  Var_98   H09   C09  C10  C11   -55.58  30.0  1
 DSL  Var_99   H131  C13  C12  C11    49.50  30.0  3
 DSL  Var_100  H132  C13  C12  C11   170.80  30.0  3
 DSL  Var_101  H133  C13  C12  C11   -68.58  30.0  3
 DSL  Var_102  H101  C10  C11  C12   -57.78  30.0  1
 DSL  Var_103  H102  C10  C11  C12  -172.57  30.0  1
 DSL  Var_104  H151  C15  C14  C12    45.01  30.0  3
 DSL  Var_105  H152  C15  C14  C12   161.61  30.0  3
 DSL  Var_106  H111  C11  C12  C13   -51.53  30.0  2
 DSL  Var_107  H112  C11  C12  C13  -168.50  30.0  2
 DSL  Var_108  H111  C11  C12  C14   130.35  30.0  2
 DSL  Var_109  H112  C11  C12  C14    13.38  30.0  2
 DSL  Var_110  H131  C13  C12  C14  -132.44  30.0  3
 DSL  Var_111  H132  C13  C12  C14   -11.13  30.0  3
 DSL  Var_112  H133  C13  C12  C14   109.49  30.0  3
 DSL  Var_113  H161  C16  C15  C14   -58.13  30.0  3
 DSL  Var_114  H162  C16  C15  C14    57.26  30.0  3
 DSL  Var_115  H14   C14  C15  C16   100.12  30.0  2
 DSL  Var_116  H181  C18  C17  C16    55.32  30.0  3
 DSL  Var_117  H182  C18  C17  C16   176.47  30.0  3
 DSL  Var_118  H183  C18  C17  C16   -62.86  30.0  3
 DSL  Var_119  H151  C15  C16  C17    54.68  30.0  1
 DSL  Var_120  H152  C15  C16  C17   -60.59  30.0  1
 DSL  Var_121  H201  C20  C19  C17   -76.17  30.0  3
 DSL  Var_122  H202  C20  C19  C17    39.49  30.0  3
 DSL  Var_123  H161  C16  C17  C18   158.65  30.0  3
 DSL  Var_124  H162  C16  C17  C18    41.18  30.0  3
 DSL  Var_125  H161  C16  C17  C19   -23.23  30.0  3
 DSL  Var_126  H162  C16  C17  C19  -140.70  30.0  3
 DSL  Var_127  H181  C18  C17  C19  -122.84  30.0  3
 DSL  Var_128  H182  C18  C17  C19    -1.68  30.0  3
 DSL  Var_129  H183  C18  C17  C19   118.98  30.0  3
 DSL  Var_130  H211  C21  C20  C19    67.87  30.0  3
 DSL  Var_131  H212  C21  C20  C19  -177.76  30.0  3
 DSL  Var_132  H19   C19  C20  C21   -18.44  30.0  3
 DSL  Var_133  H231  C23  C22  C21    59.18  30.0  3
 DSL  Var_134  H232  C23  C22  C21   180.00  30.0  3
 DSL  Var_135  H233  C23  C22  C21   -58.92  30.0  3
 DSL  Var_136  H201  C20  C21  C22  -176.74  30.0  1
 DSL  Var_137  H202  C20  C21  C22    69.15  30.0  1
 DSL  Var_138  H251  C25  C24  C22  -119.66  30.0  3
 DSL  Var_139  H252  C25  C24  C22    -2.69  30.0  3
 DSL  Var_140  H211  C21  C22  C23   -12.95  30.0  2
 DSL  Var_141  H212  C21  C22  C23  -128.56  30.0  2
 DSL  Var_142  H211  C21  C22  C24   165.96  30.0  2
 DSL  Var_143  H212  C21  C22  C24    50.35  30.0  2
 DSL  Var_144  H231  C23  C22  C24  -119.77  30.0  3
 DSL  Var_145  H232  C23  C22  C24     1.05  30.0  3
 DSL  Var_146  H233  C23  C22  C24   122.13  30.0  3
 DSL  Var_147  H261  C26  C25  C24   -57.79  30.0  3
 DSL  Var_148  H262  C26  C25  C24    56.62  30.0  3
 DSL  Var_149  H24   C24  C25  C26   -58.84  30.0  2
 DSL  Var_150  H281  C28  C27  C26   -52.21  30.0  3
 DSL  Var_151  H282  C28  C27  C26    66.96  30.0  3
 DSL  Var_152  H283  C28  C27  C26  -172.47  30.0  3
 DSL  Var_153  H251  C25  C26  C27    58.09  30.0  2
 DSL  Var_154  H252  C25  C26  C27   -58.23  30.0  2
 DSL  Var_155  H301  C30  C29  C27  -159.69  30.0  3
 DSL  Var_156  H302  C30  C29  C27   -43.06  30.0  3
 DSL  Var_157  H261  C26  C27  C28  -168.40  30.0  3
 DSL  Var_158  H262  C26  C27  C28    76.10  30.0  3
 DSL  Var_159  H261  C26  C27  C29    14.83  30.0  3
 DSL  Var_160  H262  C26  C27  C29  -100.67  30.0  3
 DSL  Var_161  H281  C28  C27  C29   124.66  30.0  3
 DSL  Var_162  H282  C28  C27  C29  -116.17  30.0  3
 DSL  Var_163  H283  C28  C27  C29     4.40  30.0  3
 DSL  Var_164  H311  C31  C30  C29   -67.26  30.0  3
 DSL  Var_165  H312  C31  C30  C29    47.24  30.0  3
 DSL  Var_166  H29   C29  C30  C31   -96.23  30.0  3
 DSL  Var_167  H331  C33  C32  C31   -69.24  30.0  3
 DSL  Var_168  H332  C33  C32  C31    49.31  30.0  3
 DSL  Var_169  H333  C33  C32  C31   170.69  30.0  3
 DSL  Var_170  H301  C30  C31  C32    51.28  30.0  1
 DSL  Var_171  H302  C30  C31  C32   -64.62  30.0  1
 DSL  Var_172  H351  C35  C34  C32  -118.80  30.0  3
 DSL  Var_173  H352  C35  C34  C32    -1.75  30.0  3
 DSL  Var_174  H311  C31  C32  C33   -59.81  30.0  2
 DSL  Var_175  H312  C31  C32  C33  -176.00  30.0  2
 DSL  Var_176  H311  C31  C32  C34   120.39  30.0  2
 DSL  Var_177  H312  C31  C32  C34     4.20  30.0  2
 DSL  Var_178  H331  C33  C32  C34   110.57  30.0  3
 DSL  Var_179  H332  C33  C32  C34  -130.87  30.0  3
 DSL  Var_180  H333  C33  C32  C34    -9.50  30.0  3
 DSL  Var_181  H361  C36  C35  C34    61.23  30.0  3
 DSL  Var_182  H362  C36  C35  C34   175.91  30.0  3
 DSL  Var_183  H34   C34  C35  C36   -57.76  30.0  2
 DSL  Var_184  H381  C38  C37  C36   -58.53  30.0  3
 DSL  Var_185  H382  C38  C37  C36    59.84  30.0  3
 DSL  Var_186  H383  C38  C37  C36  -179.28  30.0  3
 DSL  Var_187  H351  C35  C36  C37   179.05  30.0  2
 DSL  Var_188  H352  C35  C36  C37    64.28  30.0  2
 DSL  Var_189  H401  C40  C39  C37  -133.37  30.0  3
 DSL  Var_190  H402  C40  C39  C37   -15.91  30.0  3
 DSL  Var_191  H361  C36  C37  C38   -25.45  30.0  1
 DSL  Var_192  H362  C36  C37  C38  -141.81  30.0  1
 DSL  Var_193  H361  C36  C37  C39   155.06  30.0  1
 DSL  Var_194  H362  C36  C37  C39    38.71  30.0  1
 DSL  Var_195  H381  C38  C37  C39   120.97  30.0  3
 DSL  Var_196  H382  C38  C37  C39  -120.66  30.0  3
 DSL  Var_197  H383  C38  C37  C39     0.22  30.0  3
 DSL  Var_198  H411  C41  C40  C39   -67.38  30.0  3
 DSL  Var_199  H412  C41  C40  C39    46.43  30.0  3
 DSL  Var_200  H39   C39  C40  C41   -71.05  30.0  1
 DSL  Var_201  H431  C43  C42  C41   -66.33  30.0  3
 DSL  Var_202  H432  C43  C42  C41    52.10  30.0  3
 DSL  Var_203  H433  C43  C42  C41   172.92  30.0  3
 DSL  Var_204  H401  C40  C41  C42    51.24  30.0  2
 DSL  Var_205  H402  C40  C41  C42   -65.48  30.0  2
 DSL  Var_206  H451  C45  C44  C42  -123.22  30.0  3
 DSL  Var_207  H452  C45  C44  C42    -6.35  30.0  3
 DSL  Var_208  H411  C41  C42  C43   -67.13  30.0  1
 DSL  Var_209  H412  C41  C42  C43   176.98  30.0  1
 DSL  Var_210  H411  C41  C42  C44   111.01  30.0  1
 DSL  Var_211  H412  C41  C42  C44    -4.89  30.0  1
 DSL  Var_212  H431  C43  C42  C44   115.46  30.0  3
 DSL  Var_213  H432  C43  C42  C44  -126.10  30.0  3
 DSL  Var_214  H433  C43  C42  C44    -5.29  30.0  3
 DSL  Var_215  H461  C46  C45  C44   -58.58  30.0  3
 DSL  Var_216  H462  C46  C45  C44    56.76  30.0  3
 DSL  Var_217  H44   C44  C45  C46   -62.61  30.0  2
 DSL  Var_218  H481  C48  C47  C46  -176.53  30.0  3
 DSL  Var_219  H482  C48  C47  C46   -55.57  30.0  3
 DSL  Var_220  H483  C48  C47  C46    62.39  30.0  3
 DSL  Var_221  H451  C45  C46  C47    60.18  30.0  1
 DSL  Var_222  H452  C45  C46  C47   -54.75  30.0  1
 DSL  Var_223  H501  C50  C49  C47  -126.93  30.0  3
 DSL  Var_224  H502  C50  C49  C47    -9.81  30.0  3
 DSL  Var_225  H461  C46  C47  C48   -22.52  30.0  2
 DSL  Var_226  H462  C46  C47  C48  -139.67  30.0  2
 DSL  Var_227  H461  C46  C47  C49   159.60  30.0  2
 DSL  Var_228  H462  C46  C47  C49    42.45  30.0  2
 DSL  Var_229  H481  C48  C47  C49     1.38  30.0  3
 DSL  Var_230  H482  C48  C47  C49   122.34  30.0  3
 DSL  Var_231  H483  C48  C47  C49  -119.70  30.0  3
 DSL  Var_232  H511  C51  C50  C49   -50.92  30.0  3
 DSL  Var_233  H512  C51  C50  C49    64.96  30.0  3
 DSL  Var_234  H49   C49  C50  C51   -65.29  30.0  2
 DSL  Var_235  H531  C53  C52  C51    66.29  30.0  3
 DSL  Var_236  H532  C53  C52  C51  -172.86  30.0  3
 DSL  Var_237  H533  C53  C52  C51   -51.32  30.0  3
 DSL  Var_238  H501  C50  C51  C52    67.56  30.0  1
 DSL  Var_239  H502  C50  C51  C52   -47.54  30.0  1
 DSL  Var_240  H551  C55  C54  C52  -149.15  30.0  3
 DSL  Var_241  H552  C55  C54  C52   -29.33  30.0  3
 DSL  Var_242  H511  C51  C52  C53   -33.78  30.0  2
 DSL  Var_243  H512  C51  C52  C53  -151.30  30.0  2
 DSL  Var_244  H511  C51  C52  C54   148.65  30.0  2
 DSL  Var_245  H512  C51  C52  C54    31.13  30.0  2
 DSL  Var_246  H531  C53  C52  C54  -116.05  30.0  3
 DSL  Var_247  H532  C53  C52  C54     4.80  30.0  3
 DSL  Var_248  H533  C53  C52  C54   126.34  30.0  3
 DSL  Var_249  H54   C54  C55  O56   -91.02  30.0  2
 DSL  Var_250  H551  C55  O56  P57   -64.23  30.0  1
 DSL  Var_251  H552  C55  O56  P57  -178.87  30.0  1

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 DSL  plan-1   C46  0.020
 DSL  plan-1   C47  0.020
 DSL  plan-1   C48  0.020
 DSL  plan-1   C49  0.020
 DSL  plan-1   C50  0.020
 DSL  plan-1   H49  0.020
 DSL  plan-2   C51  0.020
 DSL  plan-2   C52  0.020
 DSL  plan-2   C53  0.020
 DSL  plan-2   C54  0.020
 DSL  plan-2   C55  0.020
 DSL  plan-2   H54  0.020
 DSL  plan-3   C06  0.020
 DSL  plan-3   C07  0.020
 DSL  plan-3   C08  0.020
 DSL  plan-3   C09  0.020
 DSL  plan-3   C10  0.020
 DSL  plan-3   H09  0.020
 DSL  plan-4   C11  0.020
 DSL  plan-4   C12  0.020
 DSL  plan-4   C13  0.020
 DSL  plan-4   C14  0.020
 DSL  plan-4   C15  0.020
 DSL  plan-4   H14  0.020
 DSL  plan-5   C16  0.020
 DSL  plan-5   C17  0.020
 DSL  plan-5   C18  0.020
 DSL  plan-5   C19  0.020
 DSL  plan-5   C20  0.020
 DSL  plan-5   H19  0.020
 DSL  plan-6   C21  0.020
 DSL  plan-6   C22  0.020
 DSL  plan-6   C23  0.020
 DSL  plan-6   C24  0.020
 DSL  plan-6   C25  0.020
 DSL  plan-6   H24  0.020
 DSL  plan-7   C26  0.020
 DSL  plan-7   C27  0.020
 DSL  plan-7   C28  0.020
 DSL  plan-7   C29  0.020
 DSL  plan-7   C30  0.020
 DSL  plan-7   H29  0.020
 DSL  plan-8   C31  0.020
 DSL  plan-8   C32  0.020
 DSL  plan-8   C33  0.020
 DSL  plan-8   C34  0.020
 DSL  plan-8   C35  0.020
 DSL  plan-8   H34  0.020
 DSL  plan-9   C36  0.020
 DSL  plan-9   C37  0.020
 DSL  plan-9   C38  0.020
 DSL  plan-9   C39  0.020
 DSL  plan-9   C40  0.020
 DSL  plan-9   H39  0.020
 DSL  plan-10  C41  0.020
 DSL  plan-10  C42  0.020
 DSL  plan-10  C43  0.020
 DSL  plan-10  C44  0.020
 DSL  plan-10  C45  0.020
 DSL  plan-10  H44  0.020

