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- * Data SCSI::Winchester.$.Molecules.Toluene
- DATA
- 25
- -2.45263, 0.00153,-0.00136, 1, 2, 8, 9, 10
- -0.94526, 0.00465, 0.00700, 2, 1, 3, 7
- -0.23052, 1.04754, 0.60529, 2, 2, 4, 11
- 1.16660, 1.04311, 0.60155, 2, 3, 5, 12
- 1.86112,-0.00527,-0.00395, 2, 4, 6, 13
- 1.15479,-1.04876,-0.60611, 2, 5, 7, 14
- -0.24128,-1.04120,-0.60062, 2, 2, 6, 15
- -2.83447,-0.76491, 0.71069, 5, 1
- -2.84096,-0.23606,-1.01795, 5, 1
- -2.87822, 0.98760, 0.29321, 5, 1
- -0.76582, 1.88206, 1.08781, 5, 3
- 1.72196, 1.86887, 1.07761, 5, 4
- 3.36848,-0.01474,-0.00288, 2, 5, 16, 20
- 1.70037,-1.87861,-1.08629, 5, 6
- -0.79112,-1.86882,-1.07896, 5, 7
- 4.08419,-0.61325, 1.03921, 2, 13, 17, 21
- 5.48131,-0.61053, 1.03289, 2, 16, 18, 22
- 6.17485,-0.00585,-0.01663, 2, 17, 19, 23
- 5.46755, 0.59650,-1.05933, 2, 18, 20, 24
- 4.07148, 0.59203,-1.04988, 2, 19, 13, 25
- 3.54968,-1.09512, 1.87460, 5, 16
- 6.03744,-1.08675, 1.85804, 5, 17
- 7.27793,-0.00324,-0.02227, 5, 18
- 6.01235, 1.07602,-1.89008, 5, 19
- 3.52087, 1.07053,-1.87690, 5, 20
- LEGEND
- 4-Methyl-BiPhenyl ?
-