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- * Data SCSI::Winchester.$.!Molecule.Fragments.Propyne
- DATA
- 7
- 0.00000, 0.00000, 0.00000, 1, 2, 5, 6, 7
- 1.46646, 0.00008,-0.00004, 4, 1, 3
- 2.67864, 0.00000, 0.00000, 4, 2, 4
- 3.76853,-0.00006, 0.00004, 5, 3
- -0.38114,-0.52191, 0.90628, 5, 1
- -0.38123,-0.52394,-0.90507, 5, 1
- -0.38130, 1.04577,-0.00114, 5, 1
- LEGEND
- Propyne
-