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The reaction of bis­[cyclo­penta­dienyl­tri­carbonyl­molyb­den­um(I)] with di­benzyl tri­sulfide affords the title compound, [Mo2S(C5H5)2(C7H7S)2(CO)2], as one of the products. Three independent mol­ecules exist in the asymmetric unit of the triclinic unit cell; one is related to another by a false inversion center and is related to the third by a false translation. In each dinuclear entity, each Mo atom is bonded to a cyclo­penta­dienyl anion and a carbon monoxide mol­ecule; the phenyl­methane­thiol­ate groups bridge a pair of Mo atoms, as does the sulfide atom.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536804009948/bt6454sup1.cif
Contains datablocks I, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536804009948/bt6454Isup2.hkl
Contains datablock I

CCDC reference: 239114

Key indicators

  • Single-crystal X-ray study
  • T = 223 K
  • Mean [sigma](C-C) = 0.010 Å
  • R factor = 0.066
  • wR factor = 0.216
  • Data-to-parameter ratio = 22.2

checkCIF/PLATON results

No syntax errors found



Alert level B PLAT733_ALERT_1_B Torsion Calc 117.2(5), Rep 117.20(10) ...... 5.00 su-Rat C5A -MO1A-C1A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.2(5), Rep -117.20(10) ...... 5.00 su-Rat C2A -MO1A-C1A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.7(5), Rep -116.70(10) ...... 5.00 su-Rat C3A -MO1A-C2A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.7(5), Rep 116.70(10) ...... 5.00 su-Rat C1A -MO1A-C2A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.7(5), Rep -115.80(10) ...... 5.00 su-Rat C4A -MO1A-C3A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 37.7(4), Rep 37.70(8) ...... 5.00 su-Rat C5A -MO1A-C3A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.7(5), Rep 115.80(10) ...... 5.00 su-Rat C2A -MO1A-C3A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.6(5), Rep 115.60(10) ...... 5.00 su-Rat C3A -MO1A-C4A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 37.0(4), Rep 36.97(8) ...... 5.00 su-Rat C1A -MO1A-C4A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.6(5), Rep -115.60(10) ...... 5.00 su-Rat C5A -MO1A-C4A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.5(5), Rep -116.50(10) ...... 5.00 su-Rat C1A -MO1A-C5A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.5(5), Rep 116.50(10) ...... 5.00 su-Rat C4A -MO1A-C5A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 117.2(5), Rep 117.30(10) ...... 5.00 su-Rat C10A-MO2A-C6A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.2(5), Rep -117.30(10) ...... 5.00 su-Rat C7A -MO2A-C6A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.7(5), Rep -116.70(10) ...... 5.00 su-Rat C8A -MO2A-C7A -C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.7(5), Rep 116.70(10) ...... 5.00 su-Rat C6A -MO2A-C7A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.8(5), Rep 115.70(10) ...... 5.00 su-Rat C7A -MO2A-C8A -C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.8(5), Rep -115.70(10) ...... 5.00 su-Rat C9A -MO2A-C8A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.5(5), Rep -115.60(10) ...... 5.00 su-Rat C10A-MO2A-C9A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.5(5), Rep 115.60(10) ...... 5.00 su-Rat C8A -MO2A-C9A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.5(5), Rep 116.50(10) ...... 5.00 su-Rat C9A -MO2A-C10A-C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.5(5), Rep -116.50(10) ...... 5.00 su-Rat C6A -MO2A-C10A-C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 117.0(5), Rep 117.00(10) ...... 5.00 su-Rat C2B -MO1B-C1B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.0(5), Rep -117.00(10) ...... 5.00 su-Rat C5B -MO1B-C1B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.2(5), Rep 116.10(10) ...... 5.00 su-Rat C3B -MO1B-C2B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -37.9(4), Rep -37.92(8) ...... 5.00 su-Rat C4B -MO1B-C2B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.2(5), Rep -116.10(10) ...... 5.00 su-Rat C1B -MO1B-C2B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.5(5), Rep -115.60(10) ...... 5.00 su-Rat C2B -MO1B-C3B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.5(5), Rep 115.60(10) ...... 5.00 su-Rat C4B -MO1B-C3B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.1(5), Rep -116.00(10) ...... 5.00 su-Rat C3B -MO1B-C4B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.0(5), Rep 116.00(10) ...... 5.00 su-Rat C5B -MO1B-C4B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.9(5), Rep -116.90(10) ...... 5.00 su-Rat C4B -MO1B-C5B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.9(5), Rep 116.90(10) ...... 5.00 su-Rat C1B -MO1B-C5B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 117.2(5), Rep 117.20(10) ...... 5.00 su-Rat C10B-MO2B-C6B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.2(5), Rep -117.20(10) ...... 5.00 su-Rat C7B -MO2B-C6B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.9(5), Rep -116.90(10) ...... 5.00 su-Rat C8B -MO2B-C7B -C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.9(5), Rep 116.90(10) ...... 5.00 su-Rat C6B -MO2B-C7B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.8(5), Rep 115.90(10) ...... 5.00 su-Rat C7B -MO2B-C8B -C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.8(5), Rep -115.90(10) ...... 5.00 su-Rat C9B -MO2B-C8B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.6(5), Rep -115.50(10) ...... 5.00 su-Rat C10B-MO2B-C9B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.6(5), Rep 115.50(10) ...... 5.00 su-Rat C8B -MO2B-C9B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.3(5), Rep -116.20(10) ...... 5.00 su-Rat C6B -MO2B-C10B-C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.3(5), Rep 116.20(10) ...... 5.00 su-Rat C9B -MO2B-C10B-C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.3(5), Rep -117.30(10) ...... 5.00 su-Rat C2C -MO1C-C1C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 117.3(5), Rep 117.30(10) ...... 5.00 su-Rat C5C -MO1C-C1C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.4(5), Rep 116.40(10) ...... 5.00 su-Rat C1C -MO1C-C2C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.4(5), Rep -116.40(10) ...... 5.00 su-Rat C3C -MO1C-C2C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.4(5), Rep 115.50(10) ...... 5.00 su-Rat C2C -MO1C-C3C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.4(5), Rep -115.50(10) ...... 5.00 su-Rat C4C -MO1C-C3C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.8(5), Rep 115.80(10) ...... 5.00 su-Rat C3C -MO1C-C4C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.8(5), Rep -115.80(10) ...... 5.00 su-Rat C5C -MO1C-C4C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.9(5), Rep -116.90(10) ...... 5.00 su-Rat C1C -MO1C-C5C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.9(5), Rep 116.90(10) ...... 5.00 su-Rat C4C -MO1C-C5C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -117.1(5), Rep -117.10(10) ...... 5.00 su-Rat C7C -MO2C-C6C -C10C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 117.1(5), Rep 117.10(10) ...... 5.00 su-Rat C10C-MO2C-C6C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 116.4(5), Rep 116.30(10) ...... 5.00 su-Rat C6C -MO2C-C7C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -116.4(5), Rep -116.30(10) ...... 5.00 su-Rat C8C -MO2C-C7C -C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.6(5), Rep 115.60(10) ...... 5.00 su-Rat C7C -MO2C-C8C -C9C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.6(5), Rep -115.60(10) ...... 5.00 su-Rat C9C -MO2C-C8C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc -115.9(5), Rep -115.90(10) ...... 5.00 su-Rat C10C-MO2C-C9C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_B Torsion Calc 115.9(5), Rep 115.90(10) ...... 5.00 su-Rat C8C -MO2C-C9C -C10C 1.555 1.555 1.555 1.555
Alert level C PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT062_ALERT_4_C Rescale T(min) & T(max) by ..................... 0.98 PLAT152_ALERT_1_C Supplied and Calc Volume s.u. Inconsistent ..... ? PLAT165_ALERT_3_C Nr. of Status R Flagged Non-Hydrogen Atoms ..... 66 PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 2.70 Ratio PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.00 Ratio PLAT230_ALERT_2_C Hirshfeld Test Diff for O2A - C12A .. 6.56 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Mo2A - C12A .. 8.94 su PLAT242_ALERT_2_C Check Low U(eq) as Compared to Neighbors .... C14C PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 10 PLAT732_ALERT_1_C Angle Calc 35.6(2), Rep 35.65(7) ...... 2.86 su-Rat C4C -MO1C -C5C 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.6(4), Rep 79.60(10) ...... 4.00 su-Rat C4A -MO1A-C1A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.4(3), Rep 37.40(10) ...... 3.00 su-Rat C3A -MO1A-C1A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.6(4), Rep -37.60(10) ...... 4.00 su-Rat C4A -MO1A-C1A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.9(4), Rep -79.80(10) ...... 4.00 su-Rat C3A -MO1A-C1A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 62.3(5), Rep 62.3(2) ...... 2.50 su-Rat C5A -C1A -C2A -MO1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.7(4), Rep -78.70(10) ...... 4.00 su-Rat C4A -MO1A-C2A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.8(4), Rep -36.80(10) ...... 4.00 su-Rat C5A -MO1A-C2A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 38.0(4), Rep 38.00(10) ...... 4.00 su-Rat C4A -MO1A-C2A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.9(4), Rep 79.90(10) ...... 4.00 su-Rat C5A -MO1A-C2A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.0(4), Rep -78.10(10) ...... 4.00 su-Rat C5A -MO1A-C3A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.9(3), Rep -36.90(10) ...... 3.00 su-Rat C1A -MO1A-C3A -C2A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.9(4), Rep 78.90(10) ...... 4.00 su-Rat C1A -MO1A-C3A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.1(4), Rep 78.10(10) ...... 4.00 su-Rat C2A -MO1A-C4A -C5A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.6(3), Rep -37.50(10) ...... 3.00 su-Rat C2A -MO1A-C4A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.7(4), Rep -78.70(10) ...... 4.00 su-Rat C1A -MO1A-C4A -C3A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 64.5(5), Rep 64.5(2) ...... 2.50 su-Rat C3A -C4A -C5A -MO1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -62.6(5), Rep -62.6(2) ...... 2.50 su-Rat C2A -C1A -C5A -MO1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -38.0(3), Rep -38.00(10) ...... 3.00 su-Rat C3A -MO1A-C5A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.7(3), Rep -79.70(10) ...... 3.00 su-Rat C2A -MO1A-C5A -C4A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.5(4), Rep 78.50(10) ...... 4.00 su-Rat C3A -MO1A-C5A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.7(4), Rep 36.70(10) ...... 4.00 su-Rat C2A -MO1A-C5A -C1A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.7(4), Rep 79.70(10) ...... 4.00 su-Rat C9A -MO2A-C6A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.3(3), Rep 37.40(10) ...... 3.00 su-Rat C8A -MO2A-C6A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.6(3), Rep -37.60(10) ...... 3.00 su-Rat C9A -MO2A-C6A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.9(3), Rep -79.90(10) ...... 3.00 su-Rat C8A -MO2A-C6A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.7(4), Rep -78.70(10) ...... 4.00 su-Rat C9A -MO2A-C7A -C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.8(3), Rep -36.80(10) ...... 3.00 su-Rat C10A-MO2A-C7A -C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 38.0(3), Rep 38.03(8) ...... 3.75 su-Rat C9A -MO2A-C7A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 80.0(4), Rep 80.00(10) ...... 4.00 su-Rat C10A-MO2A-C7A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.8(3), Rep 37.70(10) ...... 3.00 su-Rat C10A-MO2A-C8A -C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.0(4), Rep 78.90(10) ...... 4.00 su-Rat C6A -MO2A-C8A -C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.0(4), Rep -78.00(10) ...... 4.00 su-Rat C10A-MO2A-C8A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.8(3), Rep -36.80(8) ...... 3.75 su-Rat C6A -MO2A-C8A -C7A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.5(3), Rep -37.60(10) ...... 3.00 su-Rat C7A -MO2A-C9A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.6(4), Rep -78.60(10) ...... 4.00 su-Rat C6A -MO2A-C9A -C8A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.0(4), Rep 78.00(10) ...... 4.00 su-Rat C7A -MO2A-C9A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.9(3), Rep 37.00(10) ...... 3.00 su-Rat C6A -MO2A-C9A -C10A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.4(4), Rep 78.40(10) ...... 4.00 su-Rat C8A -MO2A-C10A-C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.7(3), Rep 36.70(10) ...... 3.00 su-Rat C7A -MO2A-C10A-C6A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -38.1(3), Rep -38.10(10) ...... 3.00 su-Rat C8A -MO2A-C10A-C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.8(4), Rep -79.80(10) ...... 4.00 su-Rat C7A -MO2A-C10A-C9A 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.3(4), Rep 79.20(10) ...... 4.00 su-Rat C3B -MO1B-C1B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.2(4), Rep 37.10(10) ...... 4.00 su-Rat C4B -MO1B-C1B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.8(3), Rep -37.80(10) ...... 3.00 su-Rat C3B -MO1B-C1B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.9(4), Rep -79.90(10) ...... 4.00 su-Rat C4B -MO1B-C1B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -63.3(5), Rep -63.2(2) ...... 2.50 su-Rat C5B -C1B -C2B -MO1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.2(4), Rep 78.20(10) ...... 4.00 su-Rat C4B -MO1B-C2B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.7(4), Rep 36.70(10) ...... 4.00 su-Rat C5B -MO1B-C2B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.4(4), Rep -79.40(10) ...... 4.00 su-Rat C5B -MO1B-C2B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.3(4), Rep -37.30(10) ...... 4.00 su-Rat C5B -MO1B-C3B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.3(4), Rep -78.40(10) ...... 4.00 su-Rat C1B -MO1B-C3B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.2(4), Rep 78.30(10) ...... 4.00 su-Rat C5B -MO1B-C3B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.2(3), Rep 37.20(10) ...... 3.00 su-Rat C1B -MO1B-C3B -C2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.2(4), Rep -78.10(10) ...... 4.00 su-Rat C2B -MO1B-C4B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.8(4), Rep -36.80(10) ...... 4.00 su-Rat C1B -MO1B-C4B -C5B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.9(3), Rep 37.87(8) ...... 3.75 su-Rat C2B -MO1B-C4B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.3(4), Rep 79.30(10) ...... 4.00 su-Rat C1B -MO1B-C4B -C3B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.1(4), Rep -79.10(10) ...... 4.00 su-Rat C3B -MO1B-C5B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.0(4), Rep -37.00(10) ...... 4.00 su-Rat C2B -MO1B-C5B -C1B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.8(3), Rep 37.80(10) ...... 3.00 su-Rat C3B -MO1B-C5B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.9(3), Rep 79.90(10) ...... 3.00 su-Rat C2B -MO1B-C5B -C4B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.4(3), Rep 79.40(10) ...... 3.00 su-Rat C9B -MO2B-C6B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.2(3), Rep 37.20(10) ...... 3.00 su-Rat C8B -MO2B-C6B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.7(4), Rep -37.70(10) ...... 4.00 su-Rat C9B -MO2B-C6B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -80.0(4), Rep -80.00(10) ...... 4.00 su-Rat C8B -MO2B-C6B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.0(4), Rep -79.00(10) ...... 4.00 su-Rat C9B -MO2B-C7B -C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.9(4), Rep -36.90(10) ...... 4.00 su-Rat C10B-MO2B-C7B -C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 38.0(3), Rep 37.96(8) ...... 3.75 su-Rat C9B -MO2B-C7B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 80.0(4), Rep 80.00(10) ...... 4.00 su-Rat C10B-MO2B-C7B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 63.6(5), Rep 63.6(2) ...... 2.50 su-Rat C6B -C7B -C8B -MO2B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.8(3), Rep 37.90(10) ...... 3.00 su-Rat C10B-MO2B-C8B -C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.1(4), Rep 79.20(10) ...... 4.00 su-Rat C6B -MO2B-C8B -C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.0(4), Rep -78.00(10) ...... 4.00 su-Rat C10B-MO2B-C8B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.7(4), Rep -36.70(10) ...... 4.00 su-Rat C6B -MO2B-C8B -C7B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.5(4), Rep -37.40(10) ...... 4.00 su-Rat C7B -MO2B-C9B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.5(4), Rep -78.40(10) ...... 4.00 su-Rat C6B -MO2B-C9B -C8B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.1(4), Rep 78.10(10) ...... 4.00 su-Rat C7B -MO2B-C9B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.1(4), Rep 37.10(10) ...... 4.00 su-Rat C6B -MO2B-C9B -C10B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -38.0(3), Rep -38.02(8) ...... 3.75 su-Rat C8B -MO2B-C10B-C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.6(4), Rep -79.60(10) ...... 4.00 su-Rat C7B -MO2B-C10B-C9B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.3(4), Rep 78.20(10) ...... 4.00 su-Rat C8B -MO2B-C10B-C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.7(4), Rep 36.70(10) ...... 4.00 su-Rat C7B -MO2B-C10B-C6B 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.7(4), Rep -79.70(10) ...... 4.00 su-Rat C3C -MO1C-C1C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.3(3), Rep -37.30(10) ...... 3.00 su-Rat C4C -MO1C-C1C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.7(3), Rep 37.70(10) ...... 3.00 su-Rat C3C -MO1C-C1C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 80.1(4), Rep 80.10(10) ...... 4.00 su-Rat C4C -MO1C-C1C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 62.5(5), Rep 62.5(2) ...... 2.50 su-Rat C5C -C1C -C2C -MO1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 38.2(3), Rep 38.12(8) ...... 3.75 su-Rat C4C -MO1C-C2C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.8(4), Rep 79.80(10) ...... 4.00 su-Rat C5C -MO1C-C2C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.3(4), Rep -78.30(10) ...... 4.00 su-Rat C4C -MO1C-C2C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.6(4), Rep -36.60(10) ...... 4.00 su-Rat C5C -MO1C-C2C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.4(3), Rep 37.50(10) ...... 3.00 su-Rat C5C -MO1C-C3C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.5(4), Rep 78.50(10) ...... 4.00 su-Rat C1C -MO1C-C3C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.0(4), Rep -78.00(10) ...... 4.00 su-Rat C5C -MO1C-C3C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.0(3), Rep -37.00(10) ...... 3.00 su-Rat C1C -MO1C-C3C -C2C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.0(4), Rep 77.90(10) ...... 4.00 su-Rat C2C -MO1C-C4C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.8(4), Rep 36.70(10) ...... 4.00 su-Rat C1C -MO1C-C4C -C5C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.9(3), Rep -37.90(10) ...... 3.00 su-Rat C2C -MO1C-C4C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.1(4), Rep -79.10(10) ...... 4.00 su-Rat C1C -MO1C-C4C -C3C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -61.9(5), Rep -61.9(2) ...... 2.50 su-Rat C2C -C1C -C5C -MO1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -38.1(3), Rep -38.10(10) ...... 3.00 su-Rat C3C -MO1C-C5C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -80.1(3), Rep -80.10(10) ...... 3.00 su-Rat C2C -MO1C-C5C -C4C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.8(4), Rep 78.80(10) ...... 4.00 su-Rat C3C -MO1C-C5C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.8(4), Rep 36.80(10) ...... 4.00 su-Rat C2C -MO1C-C5C -C1C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.5(3), Rep -79.50(10) ...... 3.00 su-Rat C8C -MO2C-C6C -C10C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.3(3), Rep -37.30(10) ...... 3.00 su-Rat C9C -MO2C-C6C -C10C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.7(4), Rep 37.70(10) ...... 4.00 su-Rat C8C -MO2C-C6C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.9(4), Rep 79.90(10) ...... 4.00 su-Rat C9C -MO2C-C6C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 38.0(3), Rep 38.00(10) ...... 3.00 su-Rat C9C -MO2C-C7C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 79.6(4), Rep 79.60(10) ...... 4.00 su-Rat C10C-MO2C-C7C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.4(4), Rep -78.40(10) ...... 4.00 su-Rat C9C -MO2C-C7C -C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -36.8(4), Rep -36.70(10) ...... 4.00 su-Rat C10C-MO2C-C7C -C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 37.4(4), Rep 37.40(10) ...... 4.00 su-Rat C10C-MO2C-C8C -C9C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.6(4), Rep 78.50(10) ...... 4.00 su-Rat C6C -MO2C-C8C -C9C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -78.2(4), Rep -78.20(10) ...... 4.00 su-Rat C10C-MO2C-C8C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.1(4), Rep -37.10(10) ...... 4.00 su-Rat C6C -MO2C-C8C -C7C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.8(3), Rep -37.79(8) ...... 3.75 su-Rat C7C -MO2C-C9C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.1(4), Rep -79.10(10) ...... 4.00 su-Rat C6C -MO2C-C9C -C8C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.1(4), Rep 78.10(10) ...... 4.00 su-Rat C7C -MO2C-C9C -C10C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.8(3), Rep 36.80(10) ...... 3.00 su-Rat C6C -MO2C-C9C -C10C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 78.9(3), Rep 78.90(10) ...... 3.00 su-Rat C8C -MO2C-C10C-C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 116.8(4), Rep 116.80(10) ...... 4.00 su-Rat C9C -MO2C-C10C-C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc 36.9(3), Rep 36.89(8) ...... 3.75 su-Rat C7C -MO2C-C10C-C6C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -37.9(4), Rep -37.90(10) ...... 4.00 su-Rat C8C -MO2C-C10C-C9C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -79.9(4), Rep -79.90(10) ...... 4.00 su-Rat C7C -MO2C-C10C-C9C 1.555 1.555 1.555 1.555 PLAT733_ALERT_1_C Torsion Calc -116.8(4), Rep -116.80(10) ...... 4.00 su-Rat C6C -MO2C-C10C-C9C 1.555 1.555 1.555 1.555
0 ALERT level A = In general: serious problem 61 ALERT level B = Potentially serious problem 137 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 190 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 5 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 2001); cell refinement: SAINT (Bruker, 2001); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEPII (Johnson, 1976); software used to prepare material for publication: SHELXL97.

Di-µ-phenylmethanethiolato-µ-sulfido-bis[carbonyl(η5– cyclopentadienyl)molybdenum(III)] top
Crystal data top
[Mo2S(C5H5)2(C7H7S)2(CO)2]Z = 6
Mr = 656.51F(000) = 1968
Triclinic, P1Dx = 1.752 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 11.325 (1) ÅCell parameters from 6754 reflections
b = 16.104 (1) Åθ = 2.6–29.2°
c = 22.723 (1) ŵ = 1.28 mm1
α = 74.15 (1)°T = 223 K
β = 86.10 (1)°Block, red
γ = 69.52 (1)°0.38 × 0.30 × 0.28 mm
V = 3732.9 (4) Å3
Data collection top
Bruker CCD area-detector
diffractometer
17028 independent reflections
Radiation source: fine-focus sealed tube11206 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.041
φ and ω scansθmax = 27.5°, θmin = 0.9°
Absorption correction: multi-scan
(SADABS; Bruker, 2001)
h = 1414
Tmin = 0.680, Tmax = 0.715k = 2019
36947 measured reflectionsl = 2929
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.066Hydrogen site location: constr
wR(F2) = 0.216H-atom parameters constrained
S = 1.07 w = 1/[σ2(Fo2) + (0.0898P)2 + 20.1592P]
where P = (Fo2 + 2Fc2)/3
17028 reflections(Δ/σ)max = 0.001
766 parametersΔρmax = 2.42 e Å3
0 restraintsΔρmin = 1.69 e Å3
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Mo1a0.53892 (6)0.96419 (4)0.64569 (3)0.02444 (16)
Mo2a0.73997 (6)0.80042 (4)0.69011 (3)0.02453 (16)
S1a0.74491 (18)0.92114 (13)0.59766 (9)0.0301 (4)
S2a0.53179 (18)0.84187 (13)0.73647 (9)0.0303 (4)
S3a0.57644 (18)0.82215 (13)0.61690 (9)0.0321 (4)
O1a0.6306 (5)1.0594 (4)0.7272 (3)0.0398 (14)
O2a0.8447 (5)0.8905 (4)0.7700 (3)0.0409 (14)
C1a0.3606 (6)1.0162 (4)0.5797 (3)0.043 (2)
H1a0.34190.97820.55960.052*
C2a0.4350 (5)1.0724 (4)0.5567 (2)0.039 (2)
H2a0.47411.07820.51870.047*
C3a0.4399 (5)1.1183 (4)0.6012 (3)0.0372 (19)
H3a0.48281.15980.59780.045*
C4a0.3686 (6)1.0904 (4)0.6517 (2)0.043 (2)
H4a0.35601.11030.68760.052*
C5a0.3196 (5)1.0273 (4)0.6384 (3)0.043 (2)
H5a0.26890.99810.66400.051*
C6a0.8157 (5)0.6523 (4)0.6736 (3)0.042 (2)
H6a0.77610.63530.64620.050*
C7a0.7901 (5)0.6430 (4)0.7367 (3)0.040 (2)
H7a0.73060.61870.75830.048*
C8a0.8701 (5)0.6769 (4)0.7613 (2)0.0364 (19)
H8a0.87290.67900.80210.044*
C9a0.9452 (5)0.7072 (4)0.7135 (3)0.041 (2)
H9a1.00640.73280.71710.049*
C10a0.9115 (5)0.6920 (4)0.6593 (2)0.0388 (19)
H10a0.94660.70580.62070.047*
C11a0.6018 (7)1.0190 (5)0.6977 (3)0.0293 (16)
C12a0.7997 (7)0.8612 (6)0.7398 (4)0.037 (2)
C13a0.8439 (8)0.9858 (5)0.6085 (4)0.0386 (19)
H13a0.82641.04210.57490.046*
H13b0.82271.00360.64690.046*
C14a0.9820 (4)0.9289 (4)0.6102 (3)0.042 (2)
C15a1.0347 (6)0.8969 (5)0.5601 (3)0.057 (3)
H15a0.98430.91090.52510.068*
C16a1.1620 (6)0.8442 (5)0.5618 (4)0.075 (4)
H16a1.19760.82250.52790.090*
C17a1.2365 (4)0.8235 (4)0.6136 (4)0.081 (4)
H17a1.32250.78790.61470.097*
C18a1.1838 (6)0.8556 (5)0.6637 (3)0.077 (4)
H18a1.23420.84160.69870.092*
C19a1.0566 (6)0.9083 (5)0.6620 (3)0.059 (3)
H19a1.02090.93000.69590.071*
C20a0.5336 (7)0.8746 (6)0.8076 (4)0.0384 (19)
H20a0.54600.82050.84240.046*
H20b0.60500.89570.80760.046*
C21a0.4128 (4)0.9501 (4)0.8153 (3)0.0372 (19)
C22a0.2969 (5)0.9403 (4)0.8106 (3)0.053 (2)
H22a0.29320.88810.80100.063*
C23a0.1864 (4)1.0078 (5)0.8200 (3)0.069 (3)
H23a0.10801.00120.81680.083*
C24a0.1918 (5)1.0851 (4)0.8342 (3)0.067 (3)
H24a0.11711.13080.84060.081*
C25a0.3077 (7)1.0949 (4)0.8390 (3)0.070 (3)
H25a0.31141.14720.84860.084*
C26a0.4182 (5)1.0274 (4)0.8295 (3)0.051 (2)
H26a0.49661.03400.83280.061*
Mo1b0.74637 (6)0.29966 (4)0.70268 (3)0.02452 (16)
Mo2b0.55033 (6)0.46500 (4)0.65326 (3)0.02402 (15)
S1b0.53165 (18)0.34340 (14)0.74194 (9)0.0307 (4)
S2b0.76386 (17)0.42332 (13)0.61384 (8)0.0260 (4)
S3b0.70134 (18)0.44135 (14)0.73314 (9)0.0307 (4)
O1b0.6758 (6)0.2076 (4)0.6127 (3)0.0442 (15)
O2b0.4618 (5)0.3783 (4)0.5645 (3)0.0392 (13)
C1b0.9153 (6)0.2517 (4)0.7735 (3)0.049 (2)
H1b0.93290.29250.79140.059*
C2b0.8333 (5)0.2016 (4)0.7966 (2)0.045 (2)
H2b0.78690.20350.83250.054*
C3b0.8334 (5)0.1484 (4)0.7560 (3)0.042 (2)
H3b0.78720.10870.76030.051*
C4b0.9156 (6)0.1655 (4)0.7079 (2)0.043 (2)
H4b0.93340.13920.67470.052*
C5b0.9663 (5)0.2294 (4)0.7187 (3)0.053 (3)
H5b1.02340.25280.69390.063*
C6b0.4698 (6)0.6116 (4)0.6718 (3)0.049 (2)
H6b0.50330.62660.70260.059*
C7b0.3702 (6)0.5756 (4)0.6786 (2)0.052 (3)
H7b0.32630.56260.71460.062*
C8b0.3486 (5)0.5626 (4)0.6214 (3)0.0365 (19)
H8b0.28790.53960.61300.044*
C9b0.4347 (5)0.5907 (4)0.57936 (19)0.0374 (19)
H9b0.44110.58940.53810.045*
C10b0.5096 (5)0.6209 (4)0.6105 (3)0.040 (2)
H10b0.57430.64320.59350.049*
C11b0.6948 (7)0.2448 (5)0.6455 (4)0.0294 (16)
C12b0.4992 (7)0.4075 (5)0.5982 (3)0.0294 (16)
C13b0.4390 (7)0.2787 (6)0.7244 (4)0.0373 (19)
H13c0.47470.25560.68910.045*
H13d0.44590.22560.75940.045*
C14b0.3007 (4)0.3366 (4)0.7105 (2)0.0330 (17)
C15b0.2312 (5)0.3849 (5)0.7509 (2)0.053 (2)
H15b0.27050.38380.78640.063*
C16b0.1036 (5)0.4349 (5)0.7389 (3)0.068 (3)
H16b0.05650.46760.76620.082*
C17b0.0454 (4)0.4366 (4)0.6864 (3)0.059 (3)
H17b0.04090.47040.67830.070*
C18b0.1149 (5)0.3882 (4)0.6460 (2)0.050 (2)
H18b0.07560.38940.61050.060*
C19b0.2426 (5)0.3383 (4)0.6581 (2)0.040 (2)
H19b0.28960.30560.63070.048*
C20b0.7692 (7)0.3961 (6)0.5398 (3)0.0314 (17)
H20c0.72360.35350.54240.038*
H20d0.72720.45250.50800.038*
C21b0.9030 (4)0.3533 (4)0.5225 (2)0.0344 (18)
C22b0.9672 (6)0.4096 (3)0.4893 (3)0.045 (2)
H22b0.92520.47340.47550.055*
C23b1.0934 (5)0.3715 (5)0.4765 (3)0.060 (3)
H23b1.13680.40950.45410.072*
C24b1.1555 (4)0.2771 (5)0.4970 (3)0.066 (3)
H24b1.24080.25130.48830.079*
C25b1.0913 (6)0.2208 (4)0.5302 (3)0.070 (4)
H25b1.13320.15690.54400.084*
C26b0.9650 (6)0.2589 (3)0.5430 (3)0.048 (2)
H26b0.92160.22080.56540.058*
Mo1c0.89757 (6)0.33012 (4)0.97753 (3)0.02518 (16)
Mo2c1.09516 (6)0.16574 (4)1.02534 (3)0.02443 (15)
S1c1.10856 (18)0.28576 (14)0.93402 (9)0.0309 (4)
S2c0.88315 (17)0.20891 (13)1.06769 (9)0.0303 (4)
S3c0.93975 (19)0.18798 (14)0.94807 (9)0.0336 (4)
O1c0.9808 (5)0.4266 (4)1.0611 (3)0.0401 (14)
O2c1.1896 (5)0.2559 (4)1.1088 (3)0.0406 (14)
C1c0.7257 (6)0.3791 (4)0.9078 (3)0.048 (2)
H1c0.70920.34000.88800.058*
C2c0.8032 (5)0.4333 (4)0.8861 (2)0.040 (2)
H2c0.84700.43630.84940.049*
C3c0.8029 (5)0.4821 (4)0.9296 (3)0.042 (2)
H3c0.84650.52310.92680.050*
C4c0.7252 (5)0.4580 (4)0.9782 (2)0.041 (2)
H4c0.70830.48031.01320.049*
C5c0.6775 (5)0.3944 (4)0.9648 (3)0.047 (2)
H5c0.62350.36720.98930.056*
C6c1.1729 (6)0.0187 (4)1.0078 (2)0.047 (2)
H6c1.13690.00320.97810.057*
C7c1.1375 (5)0.0099 (4)1.0697 (3)0.043 (2)
H7c1.07400.01261.08830.052*
C8c1.2149 (6)0.0409 (4)1.09871 (19)0.0371 (19)
H8c1.21160.04261.13980.044*
C9c1.2981 (5)0.0689 (4)1.0547 (3)0.042 (2)
H9c1.35960.09241.06150.050*
C10c1.2722 (6)0.0552 (4)0.9985 (2)0.044 (2)
H10c1.31350.06810.96160.053*
C11c0.9563 (7)0.3888 (5)1.0316 (3)0.0316 (17)
C12c1.1503 (7)0.2284 (5)1.0774 (3)0.0273 (16)
C13c1.2054 (7)0.3493 (6)0.9481 (4)0.0384 (19)
H13e1.19210.40460.91390.046*
H13f1.17770.36920.98530.046*
C14c1.3434 (4)0.2938 (4)0.9550 (3)0.0334 (17)
C15c1.4046 (6)0.2611 (5)0.9065 (2)0.058 (3)
H15c1.35960.27450.86980.069*
C16c1.5322 (6)0.2086 (5)0.9122 (3)0.073 (3)
H16c1.57360.18650.87940.088*
C17c1.5987 (4)0.1888 (4)0.9664 (4)0.066 (3)
H17c1.68500.15330.97030.079*
C18c1.5375 (5)0.2216 (5)1.0150 (3)0.070 (3)
H18c1.58250.20821.05170.084*
C19c1.4099 (6)0.2740 (5)1.0092 (2)0.056 (3)
H19c1.36850.29621.04210.067*
C20c0.8813 (7)0.2412 (6)1.1400 (4)0.0367 (19)
H20e0.89060.18721.17460.044*
H20f0.95310.26121.14160.044*
C21c0.7609 (4)0.3173 (4)1.1457 (3)0.0359 (18)
C22c0.6440 (5)0.3089 (4)1.1410 (3)0.063 (3)
H22c0.63920.25561.13350.076*
C23c0.5343 (4)0.3795 (6)1.1472 (4)0.081 (4)
H23c0.45530.37391.14400.097*
C24c0.5414 (6)0.4584 (5)1.1582 (3)0.071 (4)
H24c0.46720.50611.16250.086*
C25c0.6582 (7)0.4668 (4)1.1630 (3)0.065 (3)
H25c0.66300.52011.17040.079*
C26c0.7680 (5)0.3962 (4)1.1567 (3)0.052 (2)
H26c0.84700.40181.15990.063*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Mo1a0.0214 (3)0.0203 (3)0.0297 (3)0.0040 (2)0.0026 (2)0.0070 (3)
Mo2a0.0218 (3)0.0201 (3)0.0301 (3)0.0035 (2)0.0025 (2)0.0083 (3)
S1a0.0268 (9)0.0283 (10)0.0335 (10)0.0075 (8)0.0020 (7)0.0083 (8)
S2a0.0243 (9)0.0263 (10)0.0367 (10)0.0067 (8)0.0017 (8)0.0055 (8)
S3a0.0290 (10)0.0249 (10)0.0440 (11)0.0055 (8)0.0075 (8)0.0144 (8)
O1a0.040 (3)0.035 (3)0.050 (3)0.013 (3)0.000 (3)0.020 (3)
O2a0.040 (3)0.038 (3)0.049 (3)0.011 (3)0.008 (3)0.021 (3)
C1a0.036 (5)0.034 (5)0.057 (6)0.002 (4)0.023 (4)0.013 (4)
C2a0.040 (5)0.027 (4)0.038 (4)0.001 (4)0.005 (4)0.002 (3)
C3a0.041 (5)0.023 (4)0.040 (4)0.003 (4)0.009 (4)0.006 (3)
C4a0.043 (5)0.028 (4)0.040 (5)0.008 (4)0.005 (4)0.005 (4)
C5a0.023 (4)0.038 (5)0.059 (6)0.003 (4)0.012 (4)0.006 (4)
C6a0.040 (5)0.031 (5)0.054 (5)0.002 (4)0.007 (4)0.022 (4)
C7a0.037 (5)0.018 (4)0.061 (6)0.006 (3)0.004 (4)0.006 (4)
C8a0.038 (5)0.022 (4)0.040 (4)0.001 (3)0.006 (4)0.007 (3)
C9a0.024 (4)0.034 (5)0.056 (5)0.003 (3)0.010 (4)0.013 (4)
C10a0.033 (4)0.027 (4)0.048 (5)0.003 (3)0.001 (4)0.012 (4)
C11a0.028 (4)0.019 (4)0.038 (4)0.009 (3)0.002 (3)0.001 (3)
C12a0.025 (4)0.041 (5)0.031 (4)0.002 (4)0.003 (3)0.003 (4)
C13a0.037 (5)0.021 (4)0.059 (5)0.012 (4)0.006 (4)0.011 (4)
C14a0.027 (4)0.026 (4)0.068 (6)0.012 (3)0.006 (4)0.004 (4)
C15a0.029 (5)0.056 (6)0.079 (7)0.007 (4)0.013 (5)0.020 (5)
C16a0.042 (6)0.049 (7)0.122 (11)0.004 (5)0.025 (7)0.024 (7)
C17a0.028 (5)0.029 (5)0.164 (14)0.003 (4)0.009 (7)0.002 (7)
C18a0.042 (6)0.060 (8)0.123 (11)0.026 (6)0.020 (7)0.000 (7)
C19a0.042 (6)0.052 (6)0.091 (8)0.027 (5)0.007 (5)0.014 (6)
C20a0.030 (4)0.041 (5)0.033 (4)0.004 (4)0.004 (3)0.004 (4)
C21a0.031 (4)0.042 (5)0.026 (4)0.003 (4)0.001 (3)0.003 (3)
C22a0.035 (5)0.059 (7)0.061 (6)0.013 (5)0.007 (4)0.016 (5)
C23a0.033 (5)0.085 (9)0.073 (7)0.002 (5)0.003 (5)0.025 (7)
C24a0.059 (7)0.060 (7)0.045 (6)0.022 (6)0.002 (5)0.009 (5)
C25a0.089 (9)0.053 (7)0.050 (6)0.002 (6)0.007 (6)0.019 (5)
C26a0.062 (6)0.044 (6)0.044 (5)0.014 (5)0.012 (4)0.018 (4)
Mo1b0.0206 (3)0.0218 (3)0.0290 (3)0.0050 (3)0.0052 (2)0.0050 (3)
Mo2b0.0219 (3)0.0221 (3)0.0264 (3)0.0047 (2)0.0041 (2)0.0063 (2)
S1b0.0258 (9)0.0295 (10)0.0327 (10)0.0071 (8)0.0009 (7)0.0047 (8)
S2b0.0241 (9)0.0269 (10)0.0286 (9)0.0089 (7)0.0035 (7)0.0089 (7)
S3b0.0280 (10)0.0319 (11)0.0334 (10)0.0067 (8)0.0073 (8)0.0131 (8)
O1b0.048 (4)0.032 (3)0.055 (4)0.008 (3)0.008 (3)0.020 (3)
O2b0.035 (3)0.045 (4)0.045 (3)0.018 (3)0.004 (3)0.019 (3)
C1b0.041 (5)0.030 (5)0.071 (6)0.001 (4)0.030 (5)0.016 (4)
C2b0.033 (5)0.048 (6)0.040 (5)0.004 (4)0.014 (4)0.000 (4)
C3b0.040 (5)0.021 (4)0.057 (5)0.005 (4)0.019 (4)0.001 (4)
C4b0.038 (5)0.034 (5)0.047 (5)0.004 (4)0.011 (4)0.012 (4)
C5b0.023 (4)0.040 (5)0.066 (6)0.002 (4)0.011 (4)0.018 (5)
C6b0.055 (6)0.020 (4)0.067 (6)0.005 (4)0.028 (5)0.021 (4)
C7b0.054 (6)0.039 (5)0.034 (5)0.015 (4)0.006 (4)0.005 (4)
C8b0.025 (4)0.028 (4)0.053 (5)0.002 (3)0.005 (4)0.012 (4)
C9b0.031 (4)0.032 (5)0.039 (4)0.001 (3)0.012 (3)0.004 (4)
C10b0.029 (4)0.025 (4)0.064 (6)0.005 (3)0.009 (4)0.010 (4)
C11b0.028 (4)0.017 (4)0.040 (4)0.003 (3)0.004 (3)0.007 (3)
C12b0.022 (4)0.031 (4)0.035 (4)0.008 (3)0.001 (3)0.010 (3)
C13b0.027 (4)0.031 (4)0.053 (5)0.011 (3)0.000 (4)0.007 (4)
C14b0.029 (4)0.022 (4)0.046 (5)0.007 (3)0.001 (3)0.007 (3)
C15b0.035 (5)0.063 (7)0.057 (6)0.009 (5)0.006 (4)0.020 (5)
C16b0.033 (5)0.081 (8)0.099 (9)0.008 (5)0.011 (5)0.054 (7)
C17b0.024 (5)0.037 (5)0.104 (9)0.001 (4)0.010 (5)0.012 (5)
C18b0.031 (5)0.046 (6)0.070 (6)0.011 (4)0.016 (4)0.010 (5)
C19b0.038 (5)0.037 (5)0.049 (5)0.017 (4)0.002 (4)0.011 (4)
C20b0.029 (4)0.037 (5)0.031 (4)0.010 (3)0.002 (3)0.014 (3)
C21b0.040 (5)0.039 (5)0.023 (4)0.012 (4)0.003 (3)0.009 (3)
C22b0.051 (6)0.050 (6)0.041 (5)0.017 (5)0.012 (4)0.024 (4)
C23b0.052 (6)0.090 (9)0.058 (6)0.035 (6)0.020 (5)0.039 (6)
C24b0.038 (6)0.102 (10)0.050 (6)0.004 (6)0.005 (5)0.035 (6)
C25b0.058 (7)0.059 (7)0.050 (6)0.030 (6)0.017 (5)0.008 (5)
C26b0.051 (6)0.039 (5)0.043 (5)0.002 (4)0.003 (4)0.009 (4)
Mo1c0.0200 (3)0.0237 (3)0.0286 (3)0.0026 (3)0.0037 (2)0.0071 (3)
Mo2c0.0209 (3)0.0226 (3)0.0266 (3)0.0022 (3)0.0024 (2)0.0077 (3)
S1c0.0259 (9)0.0308 (10)0.0302 (9)0.0052 (8)0.0011 (7)0.0051 (8)
S2c0.0236 (9)0.0296 (10)0.0345 (10)0.0061 (8)0.0006 (7)0.0072 (8)
S3c0.0301 (10)0.0305 (11)0.0394 (11)0.0029 (8)0.0094 (8)0.0154 (9)
O1c0.042 (3)0.039 (3)0.046 (3)0.015 (3)0.003 (3)0.020 (3)
O2c0.034 (3)0.044 (4)0.041 (3)0.006 (3)0.004 (3)0.018 (3)
C1c0.032 (5)0.040 (5)0.068 (6)0.000 (4)0.026 (4)0.014 (5)
C2c0.041 (5)0.034 (5)0.032 (4)0.000 (4)0.011 (4)0.000 (4)
C3c0.029 (4)0.029 (5)0.058 (6)0.003 (4)0.016 (4)0.001 (4)
C4c0.031 (4)0.027 (4)0.054 (5)0.007 (3)0.010 (4)0.013 (4)
C5c0.020 (4)0.035 (5)0.071 (6)0.003 (4)0.014 (4)0.003 (4)
C6c0.052 (6)0.027 (5)0.051 (5)0.010 (4)0.017 (4)0.018 (4)
C7c0.039 (5)0.025 (4)0.056 (5)0.001 (4)0.003 (4)0.007 (4)
C8c0.042 (5)0.027 (4)0.032 (4)0.002 (4)0.008 (3)0.006 (3)
C9c0.031 (4)0.034 (5)0.047 (5)0.007 (4)0.010 (4)0.009 (4)
C10c0.044 (5)0.025 (4)0.044 (5)0.012 (4)0.005 (4)0.010 (4)
C11c0.021 (4)0.031 (4)0.033 (4)0.000 (3)0.004 (3)0.005 (3)
C12c0.031 (4)0.019 (4)0.033 (4)0.006 (3)0.001 (3)0.012 (3)
C13c0.025 (4)0.043 (5)0.043 (5)0.010 (4)0.005 (3)0.009 (4)
C14c0.025 (4)0.025 (4)0.047 (5)0.007 (3)0.003 (3)0.007 (3)
C15c0.040 (5)0.065 (7)0.059 (6)0.006 (5)0.008 (5)0.021 (5)
C16c0.043 (6)0.073 (8)0.105 (10)0.008 (6)0.024 (6)0.047 (7)
C17c0.025 (5)0.030 (5)0.127 (11)0.004 (4)0.002 (6)0.003 (6)
C18c0.035 (5)0.084 (9)0.081 (8)0.028 (6)0.014 (5)0.006 (7)
C19c0.041 (5)0.078 (8)0.054 (6)0.025 (5)0.000 (4)0.018 (5)
C20c0.028 (4)0.041 (5)0.035 (4)0.005 (4)0.000 (3)0.010 (4)
C21c0.028 (4)0.043 (5)0.029 (4)0.006 (4)0.004 (3)0.008 (4)
C22c0.031 (5)0.068 (7)0.086 (8)0.004 (5)0.009 (5)0.031 (6)
C23c0.029 (5)0.105 (11)0.092 (9)0.003 (6)0.007 (5)0.036 (8)
C24c0.061 (7)0.074 (8)0.041 (5)0.028 (6)0.006 (5)0.020 (5)
C25c0.092 (9)0.048 (6)0.050 (6)0.012 (6)0.013 (6)0.021 (5)
C26c0.059 (6)0.057 (6)0.049 (5)0.021 (5)0.017 (5)0.028 (5)
Geometric parameters (Å, º) top
Mo1a—C1a2.360 (5)C7b—C8b1.4200
Mo1a—C2a2.339 (5)C7b—H7b0.9400
Mo1a—C3a2.297 (5)C8b—C9b1.4200
Mo1a—C4a2.290 (5)C8b—H8b0.9400
Mo1a—C5a2.330 (5)C9b—C10b1.4200
Mo1a—C11a1.952 (8)C9b—H9b0.9400
Mo1a—S1a2.460 (2)C10b—H10b0.9400
Mo1a—S2a2.452 (2)C13b—C14b1.519 (8)
Mo1a—S3a2.437 (2)C13b—H13c0.9800
Mo2a—C12a1.965 (9)C13b—H13d0.9800
Mo2a—C6a2.361 (5)C14b—C15b1.3900
Mo2a—C7a2.340 (5)C14b—C19b1.3900
Mo2a—C8a2.294 (5)C15b—C16b1.3900
Mo2a—C9a2.286 (5)C15b—H15b0.9400
Mo2a—C10a2.329 (5)C16b—C17b1.3900
Mo2a—S1a2.454 (2)C16b—H16b0.9400
Mo2a—S2a2.462 (2)C17b—C18b1.3900
Mo2a—S3a2.443 (2)C17b—H17b0.9400
S1a—C13a1.842 (8)C18b—C19b1.3900
S2a—C20a1.834 (8)C18b—H18b0.9400
O1a—C11a1.181 (9)C19b—H19b0.9400
O2a—C12a1.160 (10)C20b—C21b1.503 (8)
C1a—C2a1.4200C20b—H20c0.9800
C1a—C5a1.4200C20b—H20d0.9800
C1a—H1a0.9400C21b—C22b1.3900
C2a—C3a1.4200C21b—C26b1.3900
C2a—H2a0.9400C22b—C23b1.3900
C3a—C4a1.4200C22b—H22b0.9400
C3a—H3a0.9400C23b—C24b1.3900
C4a—C5a1.4200C23b—H23b0.9400
C4a—H4a0.9400C24b—C25b1.3900
C5a—H5a0.9400C24b—H24b0.9400
C6a—C7a1.4200C25b—C26b1.3900
C6a—C10a1.4200C25b—H25b0.9400
C6a—H6a0.9400C26b—H26b0.9400
C7a—C8a1.4200Mo1c—C1c2.362 (5)
C7a—H7a0.9400Mo1c—C2c2.322 (5)
C8a—C9a1.4200Mo1c—C3c2.278 (6)
C8a—H8a0.9400Mo1c—C4c2.292 (5)
C9a—C10a1.4200Mo1c—C5c2.344 (5)
C9a—H9a0.9400Mo1c—C11c2.007 (8)
C10a—H10a0.9400Mo1c—S1c2.463 (2)
C13a—C14a1.508 (9)Mo1c—S2c2.455 (2)
C13a—H13a0.9800Mo1c—S3c2.438 (2)
C13a—H13b0.9800Mo2c—C6c2.356 (6)
C14a—C15a1.3900Mo2c—C7c2.322 (6)
C14a—C19a1.3900Mo2c—C8c2.287 (5)
C15a—C16a1.3900Mo2c—C9c2.300 (6)
C15a—H15a0.9400Mo2c—C10c2.343 (5)
C16a—C17a1.3900Mo2c—C12c2.001 (7)
C16a—H16a0.9400Mo2c—S1c2.457 (2)
C17a—C18a1.3900Mo2c—S2c2.461 (2)
C17a—H17a0.9400Mo2c—S3c2.438 (2)
C18a—C19a1.3900S1c—C13c1.835 (9)
C18a—H18a0.9400S2c—C20c1.849 (8)
C19a—H19a0.9400O1c—C11c1.124 (9)
C20a—C21a1.517 (8)O2c—C12c1.120 (9)
C20a—H20a0.9800C1c—C5c1.4200
C20a—H20b0.9800C1c—C2c1.4200
C21a—C22a1.3900C1c—H1c0.9400
C21a—C26a1.3900C2c—C3c1.4200
C22a—C23a1.3900C2c—H2c0.9400
C22a—H22a0.9400C3c—C4c1.4200
C23a—C24a1.3900C3c—H3c0.9400
C23a—H23a0.9400C4c—C5c1.4200
C24a—C25a1.3900C4c—H4c0.9400
C24a—H24a0.9400C5c—H5c0.9400
C25a—C26a1.3900C6c—C10c1.4200
C25a—H25a0.9400C6c—C7c1.4200
C26a—H26a0.9400C6c—H6c0.9400
Mo1b—C1b2.357 (6)C7c—C8c1.4200
Mo1b—C2b2.318 (6)C7c—H7c0.9400
Mo1b—C3b2.291 (6)C8c—C9c1.4200
Mo1b—C4b2.313 (6)C8c—H8c0.9400
Mo1b—C5b2.354 (6)C9c—C10c1.4200
Mo1b—C11b1.975 (8)C9c—H9c0.9400
Mo1b—S1b2.461 (2)C10c—H10c0.9400
Mo1b—S2b2.471 (2)C13c—C14c1.498 (9)
Mo1b—S3b2.439 (2)C13c—H13e0.9800
Mo2b—C6b2.360 (5)C13c—H13f0.9800
Mo2b—C7b2.350 (6)C14c—C15c1.3900
Mo2b—C8b2.303 (5)C14c—C19c1.3900
Mo2b—C9b2.284 (5)C15c—C16c1.3900
Mo2b—C10b2.320 (6)C15c—H15c0.9400
Mo2b—C12b1.967 (8)C16c—C17c1.3900
Mo2b—S1b2.453 (2)C16c—H16c0.9400
Mo2b—S2b2.449 (2)C17c—C18c1.3900
Mo2b—S3b2.440 (2)C17c—H17c0.9400
S1b—C13b1.841 (8)C18c—C19c1.3900
S2b—C20b1.844 (7)C18c—H18c0.9400
O1b—C11b1.147 (9)C19c—H19c0.9400
O2b—C12b1.169 (9)C20c—C21c1.507 (8)
C1b—C5b1.4200C20c—H20e0.9800
C1b—C2b1.4200C20c—H20f0.9800
C1b—H1b0.9400C21c—C22c1.3900
C2b—C3b1.4200C21c—C26c1.3900
C2b—H2b0.9400C22c—C23c1.3900
C3b—C4b1.4200C22c—H22c0.9400
C3b—H3b0.9400C23c—C24c1.3900
C4b—C5b1.4200C23c—H23c0.9400
C4b—H4b0.9400C24c—C25c1.3900
C5b—H5b0.9400C24c—H24c0.9400
C6b—C7b1.4200C25c—C26c1.3900
C6b—C10b1.4200C25c—H25c0.9400
C6b—H6b0.9400C26c—H26c0.9400
C1a—Mo1a—C2a35.2 (1)C2b—C3b—H3b126.0
C1a—Mo1a—C3a59.1 (1)Mo1b—C3b—H3b119.8
C1a—Mo1a—C4a59.2 (1)C5b—C4b—C3b108.0
C1a—Mo1a—C5a35.3 (1)C5b—C4b—Mo1b73.9 (2)
C1a—Mo1a—C11a134.3 (2)C3b—C4b—Mo1b71.2 (2)
C1a—Mo1a—S1a115.9 (2)C5b—C4b—H4b126.0
C1a—Mo1a—S2a112.4 (2)C3b—C4b—H4b126.0
C1a—Mo1a—S3a82.2 (1)Mo1b—C4b—H4b120.7
C2a—Mo1a—C3a35.7 (1)C1b—C5b—C4b108.0
C2a—Mo1a—C4a59.5 (1)C1b—C5b—Mo1b72.6 (2)
C2a—Mo1a—C5a59.0 (1)C4b—C5b—Mo1b70.7 (2)
C2a—Mo1a—C11a112.4 (3)C1b—C5b—H5b126.0
C2a—Mo1a—S1a94.1 (1)C4b—C5b—H5b126.0
C2a—Mo1a—S2a147.4 (2)Mo1b—C5b—H5b122.4
C2a—Mo1a—S3a100.3 (1)C7b—C6b—C10b108.0
C3a—Mo1a—C4a36.1 (1)C7b—C6b—Mo2b72.1 (2)
C3a—Mo1a—C5a59.6 (1)C10b—C6b—Mo2b70.8 (2)
C3a—Mo1a—C11a78.6 (2)C7b—C6b—H6b126.0
C3a—Mo1a—S1a106.1 (2)C10b—C6b—H6b126.0
C3a—Mo1a—S2a141.2 (2)Mo2b—C6b—H6b122.8
C3a—Mo1a—S3a135.9 (1)C6b—C7b—C8b108.0
C4a—Mo1a—C5a35.8 (1)C6b—C7b—Mo2b72.8 (2)
C4a—Mo1a—C11a76.6 (3)C8b—C7b—Mo2b70.5 (2)
C4a—Mo1a—S1a141.3 (2)C6b—C7b—H7b126.0
C4a—Mo1a—S2a105.4 (1)C8b—C7b—H7b126.0
C4a—Mo1a—S3a136.9 (2)Mo2b—C7b—H7b122.4
C5a—Mo1a—C11a109.3 (3)C9b—C8b—C7b108.0
C5a—Mo1a—S1a150.8 (2)C9b—C8b—Mo2b71.2 (2)
C5a—Mo1a—S2a91.5 (1)C7b—C8b—Mo2b74.0 (2)
C5a—Mo1a—S3a101.3 (2)C9b—C8b—H8b126.0
C11a—Mo1a—S1a90.5 (2)C7b—C8b—H8b126.0
C11a—Mo1a—S2a89.0 (2)Mo2b—C8b—H8b120.5
C11a—Mo1a—S3a143.5 (2)C8b—C9b—C10b108.0
S1a—Mo1a—S2a110.7 (1)C8b—C9b—Mo2b72.7 (2)
S1a—Mo1a—S3a70.6 (1)C10b—C9b—Mo2b73.4 (2)
S2a—Mo1a—S3a70.2 (1)C8b—C9b—H9b126.0
C6a—Mo2a—C7a35.2 (1)C10b—C9b—H9b126.0
C6a—Mo2a—C8a59.1 (1)Mo2b—C9b—H9b119.7
C6a—Mo2a—C9a59.2 (1)C9b—C10b—C6b108.0
C6a—Mo2a—C10a35.2 (1)C9b—C10b—Mo2b70.7 (2)
C6a—Mo2a—C12a134.2 (3)C6b—C10b—Mo2b73.9 (2)
C6a—Mo2a—S1a112.5 (2)C9b—C10b—H10b126.0
C6a—Mo2a—S2a115.2 (2)C6b—C10b—H10b126.0
C6a—Mo2a—S3a81.5 (1)Mo2b—C10b—H10b121.2
C7a—Mo2a—C8a35.7 (1)O1b—C11b—Mo1b173.8 (7)
C7a—Mo2a—C9a59.5 (1)O2b—C12b—Mo2b175.6 (7)
C7a—Mo2a—C10a59.0 (1)C14b—C13b—S1b112.7 (5)
C7a—Mo2a—C12a111.9 (3)C14b—C13b—H13c109.0
C7a—Mo2a—S1a147.5 (1)S1b—C13b—H13c109.0
C7a—Mo2a—S2a93.6 (1)C14b—C13b—H13d109.0
C7a—Mo2a—S3a99.4 (2)S1b—C13b—H13d109.0
C8a—Mo2a—C9a36.1 (1)H13c—C13b—H13d107.8
C8a—Mo2a—C10a59.6 (1)C15b—C14b—C19b120.0
C8a—Mo2a—C12a78.2 (3)C15b—C14b—C13b120.5 (5)
C8a—Mo2a—S1a141.8 (2)C19b—C14b—C13b119.5 (5)
C8a—Mo2a—S2a105.9 (1)C16b—C15b—C14b120.0
C8a—Mo2a—S3a135.0 (2)C16b—C15b—H15b120.0
C9a—Mo2a—C10a35.8 (2)C14b—C15b—H15b120.0
C9a—Mo2a—C12a76.8 (3)C15b—C16b—C17b120.0
C9a—Mo2a—S1a105.9 (2)C15b—C16b—H16b120.0
C9a—Mo2a—S2a141.3 (2)C17b—C16b—H16b120.0
C9a—Mo2a—S3a136.5 (1)C18b—C17b—C16b120.0
C10a—Mo2a—C12a109.7 (3)C18b—C17b—H17b120.0
C10a—Mo2a—S1a91.8 (1)C16b—C17b—H17b120.0
C10a—Mo2a—S2a150.1 (2)C17b—C18b—C19b120.0
C10a—Mo2a—S3a101.0 (2)C17b—C18b—H18b120.0
C12a—Mo2a—S1a90.1 (2)C19b—C18b—H18b120.0
C12a—Mo2a—S2a90.5 (2)C18b—C19b—C14b120.0
C12a—Mo2a—S3a144.2 (2)C18b—C19b—H19b120.0
S1a—Mo2a—S3a70.59 (7)C14b—C19b—H19b120.0
S1a—Mo2a—S2a110.55 (7)C21b—C20b—S2b111.0 (5)
S2a—Mo2a—S3a69.99 (7)C21b—C20b—H20c109.4
C13a—S1a—Mo2a112.5 (3)S2b—C20b—H20c109.4
C13a—S1a—Mo1a113.4 (3)C21b—C20b—H20d109.4
Mo2a—S1a—Mo1a69.35 (5)S2b—C20b—H20d109.4
C20a—S2a—Mo1a112.0 (3)H20c—C20b—H20d108.0
C20a—S2a—Mo2a113.0 (3)C22b—C21b—C26b120.0
Mo1a—S2a—Mo2a69.36 (5)C22b—C21b—C20b119.4 (5)
Mo1a—S3a—Mo2a69.90 (5)C26b—C21b—C20b120.5 (5)
C2a—C1a—C5a108.0C21b—C22b—C23b120.0
C2a—C1a—Mo1a71.6 (2)C21b—C22b—H22b120.0
C5a—C1a—Mo1a71.2 (2)C23b—C22b—H22b120.0
C2a—C1a—H1a126.0C24b—C23b—C22b120.0
C5a—C1a—H1a126.0C24b—C23b—H23b120.0
Mo1a—C1a—H1a122.8C22b—C23b—H23b120.0
C1a—C2a—C3a108.0C25b—C24b—C23b120.0
C1a—C2a—Mo1a73.2 (2)C25b—C24b—H24b120.0
C3a—C2a—Mo1a70.5 (2)C23b—C24b—H24b120.0
C1a—C2a—H2a126.0C24b—C25b—C26b120.0
C3a—C2a—H2a126.0C24b—C25b—H25b120.0
Mo1a—C2a—H2a122.0C26b—C25b—H25b120.0
C2a—C3a—C4a108.0C25b—C26b—C21b120.0
C2a—C3a—Mo1a73.8 (2)C25b—C26b—H26b120.0
C4a—C3a—Mo1a71.7 (2)C21b—C26b—H26b120.0
C2a—C3a—H3a126.0C1c—Mo1c—C2c35.3 (1)
C4a—C3a—H3a126.0C1c—Mo1c—C3c59.3 (1)
Mo1a—C3a—H3a120.2C1c—Mo1c—C4c59.1 (1)
C5a—C4a—C3a108.0C1c—Mo1c—C5c35.1 (1)
C5a—C4a—Mo1a73.6 (2)C1c—Mo1c—C11c134.6 (2)
C3a—C4a—Mo1a72.2 (2)C1c—Mo1c—S1c115.8 (2)
C5a—C4a—H4a126.0C1c—Mo1c—S2c111.8 (2)
C3a—C4a—H4a126.0C1c—Mo1c—S3c81.0 (1)
Mo1a—C4a—H4a120.0C2c—Mo1c—C3c36.0 (1)
C4a—C5a—C1a108.0C2c—Mo1c—C4c59.7 (1)
C4a—C5a—Mo1a70.6 (2)C2c—Mo1c—C5c59.0 (1)
C1a—C5a—Mo1a73.5 (2)C2c—Mo1c—C11c113.0 (3)
C4a—C5a—H5a126.0C2c—Mo1c—S1c93.4 (1)
C1a—C5a—H5a126.0C2c—Mo1c—S2c147.0 (2)
Mo1a—C5a—H5a121.6C3c—Mo1c—S2c142.3 (2)
C7a—C6a—C10a108.0C2c—Mo1c—S3c98.3 (2)
C7a—C6a—Mo2a71.6 (2)C3c—Mo1c—C4c36.2 (1)
C10a—C6a—Mo2a71.1 (2)C3c—Mo1c—C5c59.6 (1)
C7a—C6a—H6a126.0C3c—Mo1c—C11c78.9 (3)
C10a—C6a—H6a126.0C3c—Mo1c—S1c105.2 (2)
Mo2a—C6a—H6a122.9C3c—Mo1c—S2c142.3 (2)
C6a—C7a—C8a108.0C3c—Mo1c—S3c134.2 (2)
C6a—C7a—Mo2a73.2 (2)C4c—Mo1c—C5c35.65 (7)
C8a—C7a—Mo2a70.4 (2)C4c—Mo1c—C11c77.0 (2)
C6a—C7a—H7a126.0C4c—Mo1c—S1c140.7 (2)
C8a—C7a—H7a126.0C4c—Mo1c—S2c106.3 (2)
Mo2a—C7a—H7a122.1C4c—Mo1c—S3c136.4 (2)
C9a—C8a—C7a108.0C5c—Mo1c—C11c109.4 (3)
C9a—C8a—Mo2a71.7 (2)C5c—Mo1c—S1c150.4 (2)
C7a—C8a—Mo2a74.0 (2)C5c—Mo1c—S2c91.7 (1)
C9a—C8a—H8a126.0C5c—Mo1c—S3c101.1 (2)
C7a—C8a—H8a126.0C11c—Mo1c—S1c90.2 (2)
Mo2a—C8a—H8a120.2C11c—Mo1c—S2c89.9 (2)
C8a—C9a—C10a108.0C11c—Mo1c—S3c144.3 (2)
C8a—C9a—Mo2a72.2 (2)S1c—Mo1c—S3c70.4 (1)
C10a—C9a—Mo2a73.7 (2)S1c—Mo1c—S2c110.7 (1)
C8a—C9a—H9a126.0S2c—Mo1c—S3c70.8 (1)
C10a—C9a—H9a126.0C6c—Mo2c—C7c35.3 (1)
Mo2a—C9a—H9a119.9C6c—Mo2c—C8c59.3 (1)
C6a—C10a—C9a108.0C6c—Mo2c—C9c59.1 (1)
C6a—C10a—Mo2a73.6 (2)C6c—Mo2c—C10c35.2 (1)
C9a—C10a—Mo2a70.5 (2)C6c—Mo2c—C12c135.1 (2)
C6a—C10a—H10a126.0C6c—Mo2c—S1c111.7 (2)
C9a—C10a—H10a126.0C6c—Mo2c—S2c115.7 (2)
Mo2a—C10a—H10a121.6C6c—Mo2c—S3c80.9 (1)
O1a—C11a—Mo1a173.8 (6)C7c—Mo2c—C8c35.9 (1)
O2a—C12a—Mo2a174.0 (7)C7c—Mo2c—C9c59.6 (1)
C14a—C13a—S1a111.1 (5)C7c—Mo2c—C10c59.0 (1)
C14a—C13a—H13a109.4C7c—Mo2c—C12c113.8 (3)
S1a—C13a—H13a109.4C7c—Mo2c—S1c147.0 (2)
C14a—C13a—H13b109.4C7c—Mo2c—S2c93.0 (1)
S1a—C13a—H13b109.4C7c—Mo2c—S3c98.0 (2)
H13a—C13a—H13b108.0C8c—Mo2c—C9c36.1 (1)
C15a—C14a—C19a120.0C8c—Mo2c—C10c59.5 (1)
C15a—C14a—C13a120.0 (5)C8c—Mo2c—C12c79.7 (2)
C19a—C14a—C13a120.0 (5)C8c—Mo2c—S1c143.0 (2)
C14a—C15a—C16a120.0C8c—Mo2c—S2c104.7 (2)
C14a—C15a—H15a120.0C8c—Mo2c—S3c133.8 (2)
C16a—C15a—H15a120.0C9c—Mo2c—C10c35.6 (1)
C17a—C16a—C15a120.0C9c—Mo2c—C12c77.3 (2)
C17a—C16a—H16a120.0C9c—Mo2c—S1c107.1 (2)
C15a—C16a—H16a120.0C9c—Mo2c—S2c140.0 (2)
C18a—C17a—C16a120.0C9c—Mo2c—S3c136.5 (2)
C18a—C17a—H17a120.0C10c—Mo2c—C12c109.4 (3)
C16a—C17a—H17a120.0C10c—Mo2c—S1c92.1 (1)
C19a—C18a—C17a120.0C10c—Mo2c—S2c150.3 (2)
C19a—C18a—H18a120.0C10c—Mo2c—S3c101.3 (2)
C17a—C18a—H18a120.0C12c—Mo2c—S1c89.5 (2)
C18a—C19a—C14a120.0C12c—Mo2c—S2c90.2 (2)
C18a—C19a—H19a120.0C12c—Mo2c—S3c143.9 (2)
C14a—C19a—H19a120.0S1c—Mo2c—S2c110.7 (1)
C21a—C20a—S2a112.5 (5)S1c—Mo2c—S3c70.5 (1)
C21a—C20a—H20a109.1S2c—Mo2c—S3c70.7 (1)
S2a—C20a—H20a109.1C13c—S1c—Mo2c112.4 (3)
C21a—C20a—H20b109.1C13c—S1c—Mo1c113.4 (3)
S2a—C20a—H20b109.1Mo2c—S1c—Mo1c69.22 (6)
H20a—C20a—H20b107.8C20c—S2c—Mo1c112.4 (3)
C22a—C21a—C26a120.0C20c—S2c—Mo2c112.3 (3)
C22a—C21a—C20a120.0 (5)Mo1c—S2c—Mo2c69.28 (6)
C26a—C21a—C20a120.0 (5)Mo2c—S3c—Mo1c69.94 (6)
C23a—C22a—C21a120.0C5c—C1c—C2c108.0
C23a—C22a—H22a120.0C5c—C1c—Mo1c71.8 (2)
C21a—C22a—H22a120.0C2c—C1c—Mo1c70.8 (2)
C22a—C23a—C24a120.0C5c—C1c—H1c126.0
C22a—C23a—H23a120.0C2c—C1c—H1c126.0
C24a—C23a—H23a120.0Mo1c—C1c—H1c123.1
C23a—C24a—C25a120.0C3c—C2c—C1c108.0
C23a—C24a—H24a120.0C3c—C2c—Mo1c70.4 (2)
C25a—C24a—H24a120.0C1c—C2c—Mo1c73.9 (2)
C26a—C25a—C24a120.0C3c—C2c—H2c126.0
C26a—C25a—H25a120.0C1c—C2c—H2c126.0
C24a—C25a—H25a120.0Mo1c—C2c—H2c121.5
C25a—C26a—C21a120.0C4c—C3c—C2c108.0
C25a—C26a—H26a120.0C4c—C3c—Mo1c72.4 (2)
C21a—C26a—H26a120.0C2c—C3c—Mo1c73.7 (2)
C1b—Mo1b—C2b35.4 (1)C4c—C3c—H3c126.0
C1b—Mo1b—C3b59.2 (1)C2c—C3c—H3c126.0
C1b—Mo1b—C4b58.9 (1)Mo1c—C3c—H3c119.7
C1b—Mo1b—C5b35.1 (1)C5c—C4c—C3c108.0
C1b—Mo1b—C11b135.3 (2)C5c—C4c—Mo1c74.2 (2)
C1b—Mo1b—S1b117.3 (2)C3c—C4c—Mo1c71.4 (2)
C1b—Mo1b—S2b110.8 (2)C5c—C4c—H4c126.0
C1b—Mo1b—S3b80.7 (1)C3c—C4c—H4c126.0
C2b—Mo1b—C3b35.9 (1)Mo1c—C4c—H4c120.3
C2b—Mo1b—C4b59.5 (1)C4c—C5c—C1c108.0
C2b—Mo1b—C5b58.9 (1)C4c—C5c—Mo1c70.2 (2)
C2b—Mo1b—C11b116.8 (3)C1c—C5c—Mo1c73.1 (2)
C2b—Mo1b—S1b92.8 (1)C4c—C5c—H5c126.0
C2b—Mo1b—S2b146.1 (2)C1c—C5c—H5c126.0
C2b—Mo1b—S3b95.6 (2)Mo1c—C5c—H5c122.4
C3b—Mo1b—C4b35.9 (1)C10c—C6c—C7c108.0
C3b—Mo1b—C5b59.3 (1)C10c—C6c—Mo2c71.9 (2)
C3b—Mo1b—C11b82.0 (3)C7c—C6c—Mo2c71.0 (2)
C3b—Mo1b—S1b102.5 (2)C10c—C6c—H6c126.0
C3b—Mo1b—S2b146.2 (2)C7c—C6c—H6c126.0
C3b—Mo1b—S3b131.5 (2)Mo2c—C6c—H6c122.7
C4b—Mo1b—C5b35.4 (1)C8c—C7c—C6c108.0
C4b—Mo1b—C11b76.7 (2)C8c—C7c—Mo2c70.7 (2)
C4b—Mo1b—S1b137.2 (2)C6c—C7c—Mo2c73.7 (2)
C4b—Mo1b—S2b110.3 (2)C8c—C7c—H7c126.0
C4b—Mo1b—S3b137.5 (2)C6c—C7c—H7c126.0
C5b—Mo1b—C11b107.4 (3)Mo2c—C7c—H7c121.3
C5b—Mo1b—S1b151.0 (2)C9c—C8c—C7c108.0
C5b—Mo1b—S2b93.5 (1)C9c—C8c—Mo2c72.5 (2)
C5b—Mo1b—S3b103.0 (2)C7c—C8c—Mo2c73.4 (2)
C11b—Mo1b—S1b90.5 (2)C9c—C8c—H8c126.0
C11b—Mo1b—S2b88.5 (2)C7c—C8c—H8c126.0
C11b—Mo1b—S3b143.7 (2)Mo2c—C8c—H8c119.9
S1b—Mo1b—S2b110.0 (1)C8c—C9c—C10c108.0
S1b—Mo1b—S3b71.1 (1)C8c—C9c—Mo2c71.4 (2)
S2b—Mo1b—S3b70.1 (1)C10c—C9c—Mo2c73.8 (2)
C6b—Mo2b—C7b35.1 (1)C8c—C9c—H9c126.0
C6b—Mo2b—C8b59.0 (1)C10c—C9c—H9c126.0
C6b—Mo2b—C9b59.3 (1)Mo2c—C9c—H9c120.5
C6b—Mo2b—C10b35.3 (1)C6c—C10c—C9c108.0
C6b—Mo2b—C12b134.0 (2)C6c—C10c—Mo2c72.9 (2)
C6b—Mo2b—S1b112.2 (2)C9c—C10c—Mo2c70.6 (2)
C6b—Mo2b—S2b115.5 (2)C6c—C10c—H10c126.0
C6b—Mo2b—S3b81.0 (1)C9c—C10c—H10c126.0
C7b—Mo2b—C8b35.5 (1)Mo2c—C10c—H10c122.2
C7b—Mo2b—C9b59.4 (1)O1c—C11c—Mo1c174.9 (7)
C7b—Mo2b—C10b58.9 (1)O2c—C12c—Mo2c173.6 (7)
C7b—Mo2b—C12b108.8 (3)C14c—C13c—S1c113.1 (6)
C7b—Mo2b—S1b92.4 (1)C14c—C13c—H13e109.0
C7b—Mo2b—S2b149.9 (2)S1c—C13c—H13e109.0
C7b—Mo2b—S3b101.5 (2)C14c—C13c—H13f109.0
C8b—Mo2b—C9b36.1 (1)S1c—C13c—H13f109.0
C8b—Mo2b—C10b59.6 (1)H13e—C13c—H13f107.8
C8b—Mo2b—C12b76.4 (2)C15c—C14c—C19c120.0
C8b—Mo2b—S1b107.0 (1)C15c—C14c—C13c119.1 (5)
C8b—Mo2b—S2b139.6 (2)C19c—C14c—C13c120.9 (5)
C8b—Mo2b—S3b136.6 (2)C16c—C15c—C14c120.0
C9b—Mo2b—C10b35.9 (1)C16c—C15c—H15c120.0
C9b—Mo2b—C12b78.3 (3)C14c—C15c—H15c120.0
C9b—Mo2b—S1b142.9 (2)C15c—C16c—C17c120.0
C9b—Mo2b—S2b104.3 (1)C15c—C16c—H16c120.0
C9b—Mo2b—S3b133.7 (2)C17c—C16c—H16c120.0
C10b—Mo2b—C12b112.4 (3)C18c—C17c—C16c120.0
C10b—Mo2b—S1b147.4 (2)C18c—C17c—H17c120.0
C10b—Mo2b—S2b92.7 (1)C16c—C17c—H17c120.0
C10b—Mo2b—S3b97.8 (2)C17c—C18c—C19c120.0
C12b—Mo2b—S1b90.3 (2)C17c—C18c—H18c120.0
C12b—Mo2b—S2b90.2 (2)C19c—C18c—H18c120.0
C12b—Mo2b—S3b145.1 (2)C18c—C19c—C14c120.0
S1b—Mo2b—S2b111.02 (7)C18c—C19c—H19c120.0
S1b—Mo2b—S3b71.23 (7)C14c—C19c—H19c120.0
S2b—Mo2b—S3b70.49 (6)C21c—C20c—S2c111.9 (5)
C13b—S1b—Mo2b112.9 (3)C21c—C20c—H20e109.2
C13b—S1b—Mo1b112.9 (3)S2c—C20c—H20e109.2
Mo2b—S1b—Mo1b69.53 (6)C21c—C20c—H20f109.2
C20b—S2b—Mo2b112.1 (2)S2c—C20c—H20f109.2
C20b—S2b—Mo1b113.9 (3)H20e—C20c—H20f107.9
Mo2b—S2b—Mo1b69.42 (5)C22c—C21c—C26c120.0
Mo1b—S3b—Mo2b70.10 (5)C22c—C21c—C20c121.0 (5)
C5b—C1b—C2b108.0C26c—C21c—C20c119.0 (5)
C5b—C1b—Mo1b72.3 (2)C21c—C22c—C23c120.0
C2b—C1b—Mo1b70.8 (2)C21c—C22c—H22c120.0
C5b—C1b—H1b126.0C23c—C22c—H22c120.0
C2b—C1b—H1b126.0C22c—C23c—C24c120.0
Mo1b—C1b—H1b122.5C22c—C23c—H23c120.0
C1b—C2b—C3b108.0C24c—C23c—H23c120.0
C1b—C2b—Mo1b73.8 (2)C25c—C24c—C23c120.0
C3b—C2b—Mo1b71.0 (2)C25c—C24c—H24c120.0
C1b—C2b—H2b126.0C23c—C24c—H24c120.0
C3b—C2b—H2b126.0C24c—C25c—C26c120.0
Mo1b—C2b—H2b120.9C24c—C25c—H25c120.0
C4b—C3b—C2b108.0C26c—C25c—H25c120.0
C4b—C3b—Mo1b72.9 (2)C25c—C26c—C21c120.0
C2b—C3b—Mo1b73.1 (2)C25c—C26c—H26c120.0
C4b—C3b—H3b126.0C21c—C26c—H26c120.0
C12a—Mo2a—S1a—C13a18.6 (4)C2b—C3b—C4b—Mo1b65.2 (2)
C9a—Mo2a—S1a—C13a57.7 (3)C11b—Mo1b—C4b—C5b149.3 (3)
C8a—Mo2a—S1a—C13a52.2 (4)C3b—Mo1b—C4b—C5b116.0 (1)
C10a—Mo2a—S1a—C13a91.1 (3)C2b—Mo1b—C4b—C5b78.1 (1)
C7a—Mo2a—S1a—C13a115.5 (4)C1b—Mo1b—C4b—C5b36.8 (1)
C6a—Mo2a—S1a—C13a120.4 (3)S3b—Mo1b—C4b—C5b16.5 (3)
S3a—Mo2a—S1a—C13a167.9 (3)S1b—Mo1b—C4b—C5b134.7 (3)
S2a—Mo2a—S1a—C13a109.2 (3)S2b—Mo1b—C4b—C5b65.9 (2)
C12a—Mo2a—S1a—Mo1a89.1 (2)C11b—Mo1b—C4b—C3b94.7 (3)
C9a—Mo2a—S1a—Mo1a165.4 (1)C2b—Mo1b—C4b—C3b37.87 (8)
C8a—Mo2a—S1a—Mo1a159.9 (2)C5b—Mo1b—C4b—C3b116.0 (1)
C10a—Mo2a—S1a—Mo1a161.2 (2)C1b—Mo1b—C4b—C3b79.3 (1)
C7a—Mo2a—S1a—Mo1a136.8 (3)S3b—Mo1b—C4b—C3b99.6 (3)
C6a—Mo2a—S1a—Mo1a131.9 (1)S1b—Mo1b—C4b—C3b18.7 (3)
S3a—Mo2a—S1a—Mo1a60.2 (1)S2b—Mo1b—C4b—C3b178.1 (2)
S2a—Mo2a—S1a—Mo1a1.5 (1)Mo1b—C1b—C5b—C4b62.2 (2)
C11a—Mo1a—S1a—C13a18.7 (4)C2b—C1b—C5b—Mo1b62.2 (2)
C4a—Mo1a—S1a—C13a50.3 (4)Mo1b—C4b—C5b—C1b63.4 (2)
C3a—Mo1a—S1a—C13a59.5 (3)C3b—C4b—C5b—Mo1b63.4 (2)
C5a—Mo1a—S1a—C13a115.1 (4)C11b—Mo1b—C5b—C1b148.3 (3)
C2a—Mo1a—S1a—C13a93.7 (3)C3b—Mo1b—C5b—C1b79.1 (1)
C1a—Mo1a—S1a—C13a122.5 (3)C4b—Mo1b—C5b—C1b116.9 (1)
S3a—Mo1a—S1a—C13a166.8 (3)C2b—Mo1b—C5b—C1b37.0 (1)
S2a—Mo1a—S1a—C13a107.9 (3)S3b—Mo1b—C5b—C1b51.7 (2)
C11a—Mo1a—S1a—Mo2a87.6 (2)S1b—Mo1b—C5b—C1b22.7 (5)
C4a—Mo1a—S1a—Mo2a156.6 (2)S2b—Mo1b—C5b—C1b122.2 (2)
C3a—Mo1a—S1a—Mo2a165.9 (1)C11b—Mo1b—C5b—C4b31.4 (3)
C5a—Mo1a—S1a—Mo2a138.6 (3)C3b—Mo1b—C5b—C4b37.8 (1)
C2a—Mo1a—S1a—Mo2a159.9 (2)C2b—Mo1b—C5b—C4b79.9 (1)
C1a—Mo1a—S1a—Mo2a131.1 (1)C1b—Mo1b—C5b—C4b116.9 (1)
S3a—Mo1a—S1a—Mo2a60.5 (1)S3b—Mo1b—C5b—C4b168.7 (2)
S2a—Mo1a—S1a—Mo2a1.5 (1)S1b—Mo1b—C5b—C4b94.2 (5)
C11a—Mo1a—S2a—C20a18.7 (4)S2b—Mo1b—C5b—C4b120.9 (2)
C4a—Mo1a—S2a—C20a57.2 (3)C12b—Mo2b—C6b—C7b53.7 (5)
C3a—Mo1a—S2a—C20a51.6 (4)C9b—Mo2b—C6b—C7b79.4 (1)
C5a—Mo1a—S2a—C20a90.6 (3)C8b—Mo2b—C6b—C7b37.2 (1)
C2a—Mo1a—S2a—C20a114.1 (4)C10b—Mo2b—C6b—C7b117.2 (1)
C1a—Mo1a—S2a—C20a119.7 (3)S3b—Mo2b—C6b—C7b125.3 (2)
S3a—Mo1a—S2a—C20a168.0 (3)S2b—Mo2b—C6b—C7b171.5 (2)
S1a—Mo1a—S2a—C20a108.9 (3)S1b—Mo2b—C6b—C7b59.9 (2)
C11a—Mo1a—S2a—Mo2a88.7 (2)C12b—Mo2b—C6b—C10b63.5 (5)
C4a—Mo1a—S2a—Mo2a164.5 (2)C9b—Mo2b—C6b—C10b37.7 (1)
C3a—Mo1a—S2a—Mo2a159.0 (2)C8b—Mo2b—C6b—C10b80.0 (1)
C5a—Mo1a—S2a—Mo2a162.1 (2)C7b—Mo2b—C6b—C10b117.2 (1)
C2a—Mo1a—S2a—Mo2a138.5 (2)S3b—Mo2b—C6b—C10b117.5 (2)
C1a—Mo1a—S2a—Mo2a132.9 (1)S2b—Mo2b—C6b—C10b54.3 (2)
S3a—Mo1a—S2a—Mo2a60.7 (1)S1b—Mo2b—C6b—C10b177.1 (2)
S1a—Mo1a—S2a—Mo2a1.53 (7)C10b—C6b—C7b—C8b0.0
C12a—Mo2a—S2a—C20a17.2 (4)Mo2b—C6b—C7b—C8b62.1 (2)
C9a—Mo2a—S2a—C20a52.1 (4)C10b—C6b—C7b—Mo2b62.1 (2)
C8a—Mo2a—S2a—C20a60.7 (3)C12b—Mo2b—C7b—C6b142.2 (3)
C10a—Mo2a—S2a—C20a116.6 (4)C9b—Mo2b—C7b—C6b79.0 (1)
C7a—Mo2a—S2a—C20a94.8 (3)C8b—Mo2b—C7b—C6b116.9 (1)
C6a—Mo2a—S2a—C20a123.6 (3)C10b—Mo2b—C7b—C6b36.9 (1)
S3a—Mo2a—S2a—C20a166.5 (3)S3b—Mo2b—C7b—C6b55.3 (2)
S1a—Mo2a—S2a—C20a107.5 (3)S2b—Mo2b—C7b—C6b15.5 (4)
C12a—Mo2a—S2a—Mo1a88.8 (2)S1b—Mo2b—C7b—C6b126.7 (2)
C9a—Mo2a—S2a—Mo1a158.0 (2)C12b—Mo2b—C7b—C8b25.3 (3)
C8a—Mo2a—S2a—Mo1a166.7 (1)C9b—Mo2b—C7b—C8b37.96 (8)
C10a—Mo2a—S2a—Mo1a137.5 (3)C10b—Mo2b—C7b—C8b80.0 (1)
C7a—Mo2a—S2a—Mo1a159.3 (2)C6b—Mo2b—C7b—C8b116.9 (1)
C6a—Mo2a—S2a—Mo1a130.5 (1)S3b—Mo2b—C7b—C8b172.3 (2)
S3a—Mo2a—S2a—Mo1a60.6 (1)S2b—Mo2b—C7b—C8b101.4 (4)
S1a—Mo2a—S2a—Mo1a1.53 (7)S1b—Mo2b—C7b—C8b116.4 (2)
C11a—Mo1a—S3a—Mo2a2.1 (4)Mo2b—C7b—C8b—C9b63.6 (2)
C4a—Mo1a—S3a—Mo2a152.8 (2)C6b—C7b—C8b—Mo2b63.6 (2)
C3a—Mo1a—S3a—Mo2a153.9 (2)C12b—Mo2b—C8b—C9b88.7 (3)
C5a—Mo1a—S3a—Mo2a148.6 (1)C10b—Mo2b—C8b—C9b37.9 (1)
C2a—Mo1a—S3a—Mo2a151.3 (1)C7b—Mo2b—C8b—C9b115.9 (1)
C1a—Mo1a—S3a—Mo2a178.4 (2)C6b—Mo2b—C8b—C9b79.2 (1)
S2a—Mo1a—S3a—Mo2a61.1 (1)S3b—Mo2b—C8b—C9b104.8 (3)
S1a—Mo1a—S3a—Mo2a60.6 (1)S2b—Mo2b—C8b—C9b14.8 (3)
C12a—Mo2a—S3a—Mo1a0.1 (4)S1b—Mo2b—C8b—C9b174.7 (2)
C9a—Mo2a—S3a—Mo1a153.7 (2)C12b—Mo2b—C8b—C7b155.4 (3)
C8a—Mo2a—S3a—Mo1a153.6 (2)C9b—Mo2b—C8b—C7b115.9 (1)
C10a—Mo2a—S3a—Mo1a148.8 (1)C10b—Mo2b—C8b—C7b78.0 (1)
C7a—Mo2a—S3a—Mo1a151.2 (1)C6b—Mo2b—C8b—C7b36.7 (1)
C6a—Mo2a—S3a—Mo1a178.4 (2)S3b—Mo2b—C8b—C7b11.1 (3)
S1a—Mo2a—S3a—Mo1a60.8 (1)S2b—Mo2b—C8b—C7b130.7 (3)
S2a—Mo2a—S3a—Mo1a60.8 (1)S1b—Mo2b—C8b—C7b69.4 (2)
C11a—Mo1a—C1a—C2a62.7 (4)Mo2b—C8b—C9b—C10b65.4 (2)
C4a—Mo1a—C1a—C2a79.6 (1)C7b—C8b—C9b—Mo2b65.4 (2)
C3a—Mo1a—C1a—C2a37.4 (1)C12b—Mo2b—C9b—C8b83.0 (3)
C5a—Mo1a—C1a—C2a117.2 (1)C10b—Mo2b—C9b—C8b115.5 (1)
S3a—Mo1a—C1a—C2a120.5 (2)C7b—Mo2b—C9b—C8b37.4 (1)
S2a—Mo1a—C1a—C2a174.7 (2)C6b—Mo2b—C9b—C8b78.4 (1)
S1a—Mo1a—C1a—C2a56.5 (2)S3b—Mo2b—C9b—C8b113.3 (3)
C11a—Mo1a—C1a—C5a54.5 (4)S2b—Mo2b—C9b—C8b170.2 (2)
C4a—Mo1a—C1a—C5a37.6 (1)S1b—Mo2b—C9b—C8b8.3 (3)
C3a—Mo1a—C1a—C5a79.8 (1)C12b—Mo2b—C9b—C10b161.5 (3)
C2a—Mo1a—C1a—C5a117.2 (1)C8b—Mo2b—C9b—C10b115.5 (1)
S3a—Mo1a—C1a—C5a122.4 (2)C7b—Mo2b—C9b—C10b78.1 (1)
S2a—Mo1a—C1a—C5a57.6 (2)C6b—Mo2b—C9b—C10b37.1 (1)
S1a—Mo1a—C1a—C5a173.7 (2)S3b—Mo2b—C9b—C10b2.2 (3)
Mo1a—C1a—C2a—C3a62.3 (2)S2b—Mo2b—C9b—C10b74.3 (2)
C5a—C1a—C2a—Mo1a62.3 (2)S1b—Mo2b—C9b—C10b123.8 (3)
C11a—Mo1a—C2a—C1a136.5 (3)Mo2b—C9b—C10b—C6b65.0 (2)
C4a—Mo1a—C2a—C1a78.7 (1)C8b—C9b—C10b—Mo2b65.0 (2)
C3a—Mo1a—C2a—C1a116.7 (1)Mo2b—C6b—C10b—C9b62.9 (2)
C5a—Mo1a—C2a—C1a36.8 (1)C7b—C6b—C10b—Mo2b62.9 (2)
S3a—Mo1a—C2a—C1a60.2 (2)C12b—Mo2b—C10b—C9b19.6 (3)
S2a—Mo1a—C2a—C1a9.0 (3)C8b—Mo2b—C10b—C9b38.02 (8)
S1a—Mo1a—C2a—C1a131.2 (2)C7b—Mo2b—C10b—C9b79.6 (1)
C11a—Mo1a—C2a—C3a19.8 (3)C6b—Mo2b—C10b—C9b116.2 (1)
C4a—Mo1a—C2a—C3a38.0 (1)S3b—Mo2b—C10b—C9b178.4 (2)
C5a—Mo1a—C2a—C3a79.9 (1)S2b—Mo2b—C10b—C9b111.0 (2)
C1a—Mo1a—C2a—C3a116.7 (1)S1b—Mo2b—C10b—C9b111.3 (3)
S3a—Mo1a—C2a—C3a176.9 (2)C12b—Mo2b—C10b—C6b135.8 (3)
S2a—Mo1a—C2a—C3a107.7 (3)C9b—Mo2b—C10b—C6b116.2 (1)
S1a—Mo1a—C2a—C3a112.1 (2)C8b—Mo2b—C10b—C6b78.2 (1)
Mo1a—C2a—C3a—C4a64.1 (2)C7b—Mo2b—C10b—C6b36.7 (1)
C1a—C2a—C3a—Mo1a64.1 (2)S3b—Mo2b—C10b—C6b62.1 (2)
C11a—Mo1a—C3a—C2a161.4 (3)S2b—Mo2b—C10b—C6b132.8 (2)
C4a—Mo1a—C3a—C2a115.8 (1)S1b—Mo2b—C10b—C6b5.0 (3)
C5a—Mo1a—C3a—C2a78.1 (1)Mo2b—S1b—C13b—C14b67.5 (6)
C1a—Mo1a—C3a—C2a36.9 (1)Mo1b—S1b—C13b—C14b143.9 (5)
S3a—Mo1a—C3a—C2a4.4 (3)S1b—C13b—C14b—C15b52.4 (7)
S2a—Mo1a—C3a—C2a124.9 (3)S1b—C13b—C14b—C19b129.9 (5)
S1a—Mo1a—C3a—C2a74.1 (2)C13b—C14b—C15b—C16b177.6 (6)
C11a—Mo1a—C3a—C4a82.9 (3)C13b—C14b—C19b—C18b177.6 (6)
C5a—Mo1a—C3a—C4a37.70 (8)Mo2b—S2b—C20b—C21b168.9 (4)
C2a—Mo1a—C3a—C4a115.8 (1)Mo1b—S2b—C20b—C21b92.6 (5)
C1a—Mo1a—C3a—C4a78.9 (1)S2b—C20b—C21b—C22b88.9 (5)
S3a—Mo1a—C3a—C4a111.4 (3)S2b—C20b—C21b—C26b86.9 (6)
S2a—Mo1a—C3a—C4a9.1 (3)C20b—C21b—C22b—C23b175.8 (5)
S1a—Mo1a—C3a—C4a170.1 (2)C20b—C21b—C26b—C25b175.7 (5)
Mo1a—C3a—C4a—C5a65.4 (2)C12c—Mo2c—S1c—C13c18.7 (4)
C2a—C3a—C4a—Mo1a65.4 (2)C8c—Mo2c—S1c—C13c53.4 (4)
C11a—Mo1a—C4a—C5a155.4 (3)C9c—Mo2c—S1c—C13c57.9 (3)
C3a—Mo1a—C4a—C5a115.6 (1)C7c—Mo2c—S1c—C13c118.0 (4)
C2a—Mo1a—C4a—C5a78.1 (1)C10c—Mo2c—S1c—C13c90.7 (3)
C1a—Mo1a—C4a—C5a36.97 (8)C6c—Mo2c—S1c—C13c120.8 (3)
S3a—Mo1a—C4a—C5a7.1 (3)S3c—Mo2c—S1c—C13c168.0 (3)
S2a—Mo1a—C4a—C5a70.3 (2)S2c—Mo2c—S1c—C13c108.7 (3)
S1a—Mo1a—C4a—C5a130.9 (3)C12c—Mo2c—S1c—Mo1c89.0 (2)
C11a—Mo1a—C4a—C3a88.9 (3)C8c—Mo2c—S1c—Mo1c161.0 (2)
C5a—Mo1a—C4a—C3a115.6 (1)C9c—Mo2c—S1c—Mo1c165.5 (1)
C2a—Mo1a—C4a—C3a37.5 (1)C7c—Mo2c—S1c—Mo1c134.4 (3)
C1a—Mo1a—C4a—C3a78.7 (1)C10c—Mo2c—S1c—Mo1c161.6 (2)
S3a—Mo1a—C4a—C3a108.5 (3)C6c—Mo2c—S1c—Mo1c131.6 (2)
S2a—Mo1a—C4a—C3a174.1 (2)S3c—Mo2c—S1c—Mo1c60.4 (1)
S1a—Mo1a—C4a—C3a15.3 (3)S2c—Mo2c—S1c—Mo1c1.01 (7)
Mo1a—C4a—C5a—C1a64.5 (2)C11c—Mo1c—S1c—C13c17.3 (4)
C3a—C4a—C5a—Mo1a64.5 (2)C3c—Mo1c—S1c—C13c61.3 (3)
Mo1a—C1a—C5a—C4a62.6 (2)C4c—Mo1c—S1c—C13c52.2 (4)
C2a—C1a—C5a—Mo1a62.6 (2)C2c—Mo1c—S1c—C13c95.8 (3)
C11a—Mo1a—C5a—C4a25.4 (3)C5c—Mo1c—S1c—C13c115.6 (4)
C3a—Mo1a—C5a—C4a38.0 (1)C1c—Mo1c—S1c—C13c124.2 (3)
C2a—Mo1a—C5a—C4a79.7 (1)S3c—Mo1c—S1c—C13c166.7 (3)
C1a—Mo1a—C5a—C4a116.5 (1)S2c—Mo1c—S1c—C13c107.3 (3)
S3a—Mo1a—C5a—C4a175.0 (2)C11c—Mo1c—S1c—Mo2c88.9 (2)
S2a—Mo1a—C5a—C4a114.8 (2)C3c—Mo1c—S1c—Mo2c167.5 (2)
S1a—Mo1a—C5a—C4a104.8 (4)C4c—Mo1c—S1c—Mo2c158.4 (2)
C11a—Mo1a—C5a—C1a141.8 (3)C2c—Mo1c—S1c—Mo2c158.0 (2)
C4a—Mo1a—C5a—C1a116.5 (1)C5c—Mo1c—S1c—Mo2c138.2 (3)
C3a—Mo1a—C5a—C1a78.5 (1)C1c—Mo1c—S1c—Mo2c129.6 (2)
C2a—Mo1a—C5a—C1a36.7 (1)S3c—Mo1c—S1c—Mo2c60.4 (1)
S3a—Mo1a—C5a—C1a58.6 (2)S2c—Mo1c—S1c—Mo2c1.02 (7)
S2a—Mo1a—C5a—C1a128.7 (2)C11c—Mo1c—S2c—C20c17.3 (3)
S1a—Mo1a—C5a—C1a11.7 (4)C3c—Mo1c—S2c—C20c54.2 (4)
C12a—Mo2a—C6a—C7a61.4 (4)C4c—Mo1c—S2c—C20c59.1 (3)
C9a—Mo2a—C6a—C7a79.7 (1)C2c—Mo1c—S2c—C20c118.2 (4)
C8a—Mo2a—C6a—C7a37.4 (1)C5c—Mo1c—S2c—C20c92.1 (3)
C10a—Mo2a—C6a—C7a117.3 (1)C1c—Mo1c—S2c—C20c121.8 (3)
S3a—Mo2a—C6a—C7a119.8 (2)S3c—Mo1c—S2c—C20c166.7 (3)
S1a—Mo2a—C6a—C7a175.4 (2)S1c—Mo1c—S2c—C20c107.5 (3)
S2a—Mo2a—C6a—C7a56.7 (2)C11c—Mo1c—S2c—Mo2c89.2 (2)
C12a—Mo2a—C6a—C10a55.8 (4)C3c—Mo1c—S2c—Mo2c160.7 (2)
C9a—Mo2a—C6a—C10a37.6 (1)C4c—Mo1c—S2c—Mo2c165.6 (2)
C8a—Mo2a—C6a—C10a79.9 (1)C2c—Mo1c—S2c—Mo2c135.3 (3)
C7a—Mo2a—C6a—C10a117.3 (1)C5c—Mo1c—S2c—Mo2c161.4 (2)
S3a—Mo2a—C6a—C10a122.9 (2)C1c—Mo1c—S2c—Mo2c131.7 (2)
S1a—Mo2a—C6a—C10a58.1 (2)S3c—Mo1c—S2c—Mo2c60.2 (1)
S2a—Mo2a—C6a—C10a174.0 (2)S1c—Mo1c—S2c—Mo2c1.0 (1)
Mo2a—C6a—C7a—C8a62.2 (2)C12c—Mo2c—S2c—C20c18.1 (4)
C10a—C6a—C7a—Mo2a62.2 (2)C8c—Mo2c—S2c—C20c61.3 (3)
C12a—Mo2a—C7a—C6a137.3 (3)C9c—Mo2c—S2c—C20c52.2 (4)
C9a—Mo2a—C7a—C6a78.7 (1)C7c—Mo2c—S2c—C20c95.8 (3)
C8a—Mo2a—C7a—C6a116.7 (1)C10c—Mo2c—S2c—C20c114.4 (4)
C10a—Mo2a—C7a—C6a36.8 (1)C6c—Mo2c—S2c—C20c124.0 (3)
S3a—Mo2a—C7a—C6a60.4 (2)S3c—Mo2c—S2c—C20c166.9 (3)
S1a—Mo2a—C7a—C6a8.0 (4)S1c—Mo2c—S2c—C20c107.6 (3)
S2a—Mo2a—C7a—C6a130.7 (2)C12c—Mo2c—S2c—Mo1c88.5 (2)
C12a—Mo2a—C7a—C8a20.5 (3)C8c—Mo2c—S2c—Mo1c167.9 (2)
C9a—Mo2a—C7a—C8a38.03 (8)C9c—Mo2c—S2c—Mo1c158.8 (2)
C10a—Mo2a—C7a—C8a80.0 (1)C7c—Mo2c—S2c—Mo1c157.7 (2)
C6a—Mo2a—C7a—C8a116.7 (1)C10c—Mo2c—S2c—Mo1c139.0 (3)
S3a—Mo2a—C7a—C8a177.2 (2)C6c—Mo2c—S2c—Mo1c129.4 (1)
S1a—Mo2a—C7a—C8a108.7 (3)S3c—Mo2c—S2c—Mo1c60.3 (1)
S2a—Mo2a—C7a—C8a112.5 (2)S1c—Mo2c—S2c—Mo1c1.02 (7)
Mo2a—C7a—C8a—C9a64.0 (2)C12c—Mo2c—S3c—Mo1c1.0 (4)
C6a—C7a—C8a—Mo2a64.0 (2)C8c—Mo2c—S3c—Mo1c152.6 (2)
C12a—Mo2a—C8a—C9a83.7 (3)C9c—Mo2c—S3c—Mo1c155.5 (2)
C10a—Mo2a—C8a—C9a37.7 (1)C7c—Mo2c—S3c—Mo1c151.0 (1)
C7a—Mo2a—C8a—C9a115.7 (1)C10c—Mo2c—S3c—Mo1c149.2 (1)
C6a—Mo2a—C8a—C9a78.9 (1)C6c—Mo2c—S3c—Mo1c178.0 (2)
S3a—Mo2a—C8a—C9a111.8 (3)S1c—Mo2c—S3c—Mo1c60.9 (1)
S1a—Mo2a—C8a—C9a8.9 (3)S2c—Mo2c—S3c—Mo1c60.6 (1)
S2a—Mo2a—C8a—C9a170.8 (2)C11c—Mo1c—S3c—Mo2c0.0 (4)
C12a—Mo2a—C8a—C7a160.6 (3)C3c—Mo1c—S3c—Mo2c153.2 (2)
C9a—Mo2a—C8a—C7a115.7 (1)C4c—Mo1c—S3c—Mo2c154.5 (2)
C10a—Mo2a—C8a—C7a78.0 (1)C2c—Mo1c—S3c—Mo2c151.4 (1)
C6a—Mo2a—C8a—C7a36.80 (8)C5c—Mo1c—S3c—Mo2c148.7 (1)
S3a—Mo2a—C8a—C7a3.9 (3)C1c—Mo1c—S3c—Mo2c177.7 (2)
S1a—Mo2a—C8a—C7a124.6 (3)S2c—Mo1c—S3c—Mo2c60.8 (1)
S2a—Mo2a—C8a—C7a73.4 (2)S1c—Mo1c—S3c—Mo2c60.7 (1)
Mo2a—C8a—C9a—C10a65.5 (2)C11c—Mo1c—C1c—C5c53.8 (5)
C7a—C8a—C9a—Mo2a65.5 (2)C3c—Mo1c—C1c—C5c79.7 (1)
C12a—Mo2a—C9a—C8a88.1 (3)C4c—Mo1c—C1c—C5c37.3 (1)
C10a—Mo2a—C9a—C8a115.6 (1)C2c—Mo1c—C1c—C5c117.3 (1)
C7a—Mo2a—C9a—C8a37.6 (1)S3c—Mo1c—C1c—C5c124.3 (2)
C6a—Mo2a—C9a—C8a78.6 (1)S2c—Mo1c—C1c—C5c59.3 (2)
S3a—Mo2a—C9a—C8a107.3 (3)S1c—Mo1c—C1c—C5c172.7 (2)
S1a—Mo2a—C9a—C8a174.3 (2)C11c—Mo1c—C1c—C2c63.6 (5)
S2a—Mo2a—C9a—C8a14.2 (3)C3c—Mo1c—C1c—C2c37.7 (1)
C12a—Mo2a—C9a—C10a156.4 (3)C4c—Mo1c—C1c—C2c80.1 (1)
C8a—Mo2a—C9a—C10a115.6 (1)C5c—Mo1c—C1c—C2c117.3 (1)
C7a—Mo2a—C9a—C10a78.0 (1)S3c—Mo1c—C1c—C2c118.4 (2)
C6a—Mo2a—C9a—C10a37.0 (1)S2c—Mo1c—C1c—C2c176.6 (2)
S3a—Mo2a—C9a—C10a8.3 (3)S1c—Mo1c—C1c—C2c55.3 (2)
S1a—Mo2a—C9a—C10a70.1 (2)Mo1c—C1c—C2c—C3c62.5 (2)
S2a—Mo2a—C9a—C10a129.8 (3)C5c—C1c—C2c—Mo1c62.5 (2)
Mo2a—C6a—C10a—C9a62.5 (2)C11c—Mo1c—C2c—C3c19.8 (3)
C7a—C6a—C10a—Mo2a62.5 (2)C4c—Mo1c—C2c—C3c38.12 (8)
Mo2a—C9a—C10a—C6a64.6 (2)C5c—Mo1c—C2c—C3c79.8 (1)
C8a—C9a—C10a—Mo2a64.6 (2)C1c—Mo1c—C2c—C3c116.4 (1)
C12a—Mo2a—C10a—C6a141.0 (3)S3c—Mo1c—C2c—C3c177.8 (2)
C9a—Mo2a—C10a—C6a116.5 (1)S2c—Mo1c—C2c—C3c110.6 (4)
C8a—Mo2a—C10a—C6a78.4 (1)S1c—Mo1c—C2c—C3c111.5 (2)
C7a—Mo2a—C10a—C6a36.7 (1)C11c—Mo1c—C2c—C1c136.2 (3)
S3a—Mo2a—C10a—C6a57.7 (2)C3c—Mo1c—C2c—C1c116.4 (1)
S1a—Mo2a—C10a—C6a128.3 (2)C4c—Mo1c—C2c—C1c78.3 (1)
S2a—Mo2a—C10a—C6a11.0 (4)C5c—Mo1c—C2c—C1c36.6 (1)
C12a—Mo2a—C10a—C9a24.5 (3)S3c—Mo1c—C2c—C1c61.5 (2)
C8a—Mo2a—C10a—C9a38.1 (1)S2c—Mo1c—C2c—C1c5.8 (4)
C7a—Mo2a—C10a—C9a79.8 (1)S1c—Mo1c—C2c—C1c132.1 (2)
C6a—Mo2a—C10a—C9a116.5 (1)Mo1c—C2c—C3c—C4c64.8 (2)
S3a—Mo2a—C10a—C9a174.2 (2)C1c—C2c—C3c—Mo1c64.8 (2)
S1a—Mo2a—C10a—C9a115.2 (2)C11c—Mo1c—C3c—C4c83.1 (3)
S2a—Mo2a—C10a—C9a105.5 (4)C2c—Mo1c—C3c—C4c115.5 (1)
Mo2a—S1a—C13a—C14a73.3 (6)C5c—Mo1c—C3c—C4c37.5 (1)
Mo1a—S1a—C13a—C14a149.6 (5)C1c—Mo1c—C3c—C4c78.5 (1)
S1a—C13a—C14a—C15a60.2 (7)S3c—Mo1c—C3c—C4c112.5 (3)
S1a—C13a—C14a—C19a119.5 (5)S2c—Mo1c—C3c—C4c7.9 (3)
C13a—C14a—C15a—C16a179.7 (6)S1c—Mo1c—C3c—C4c170.2 (2)
C13a—C14a—C19a—C18a179.7 (6)C11c—Mo1c—C3c—C2c161.5 (3)
Mo1a—S2a—C20a—C21a68.9 (6)C4c—Mo1c—C3c—C2c115.5 (1)
Mo2a—S2a—C20a—C21a144.9 (5)C5c—Mo1c—C3c—C2c78.0 (1)
S2a—C20a—C21a—C22a52.4 (7)C1c—Mo1c—C3c—C2c37.0 (1)
S2a—C20a—C21a—C26a130.1 (5)S3c—Mo1c—C3c—C2c3.0 (3)
C20a—C21a—C22a—C23a177.5 (6)S2c—Mo1c—C3c—C2c123.4 (3)
C20a—C21a—C26a—C25a177.5 (6)S1c—Mo1c—C3c—C2c74.3 (2)
C12b—Mo2b—S1b—C13b17.0 (4)Mo1c—C3c—C4c—C5c65.6 (2)
C9b—Mo2b—S1b—C13b53.7 (4)C2c—C3c—C4c—Mo1c65.6 (2)
C8b—Mo2b—S1b—C13b58.9 (3)C11c—Mo1c—C4c—C5c155.3 (3)
C10b—Mo2b—S1b—C13b118.6 (4)C3c—Mo1c—C4c—C5c115.8 (1)
C7b—Mo2b—S1b—C13b91.8 (3)C2c—Mo1c—C4c—C5c77.9 (1)
C6b—Mo2b—S1b—C13b121.7 (3)C1c—Mo1c—C4c—C5c36.7 (1)
S3b—Mo2b—S1b—C13b166.8 (3)S3c—Mo1c—C4c—C5c9.7 (3)
S2b—Mo2b—S1b—C13b107.4 (3)S2c—Mo1c—C4c—C5c69.3 (2)
C12b—Mo2b—S1b—Mo1b90.0 (2)S1c—Mo1c—C4c—C5c130.8 (3)
C9b—Mo2b—S1b—Mo1b160.7 (2)C11c—Mo1c—C4c—C3c89.0 (3)
C8b—Mo2b—S1b—Mo1b165.87 (14)C2c—Mo1c—C4c—C3c37.9 (1)
C10b—Mo2b—S1b—Mo1b134.4 (2)C5c—Mo1c—C4c—C3c115.8 (1)
C7b—Mo2b—S1b—Mo1b161.2 (2)C1c—Mo1c—C4c—C3c79.1 (1)
C6b—Mo2b—S1b—Mo1b131.3 (2)S3c—Mo1c—C4c—C3c106.0 (3)
S3b—Mo2b—S1b—Mo1b59.8 (1)S2c—Mo1c—C4c—C3c175.0 (2)
S2b—Mo2b—S1b—Mo1b0.4 (1)S1c—Mo1c—C4c—C3c15.0 (3)
C11b—Mo1b—S1b—C13b18.8 (4)Mo1c—C4c—C5c—C1c63.8 (2)
C3b—Mo1b—S1b—C13b63.1 (3)C3c—C4c—C5c—Mo1c63.8 (2)
C4b—Mo1b—S1b—C13b52.0 (4)Mo1c—C1c—C5c—C4c61.9 (2)
C2b—Mo1b—S1b—C13b98.0 (3)C2c—C1c—C5c—Mo1c61.9 (2)
C5b—Mo1b—S1b—C13b110.2 (4)C11c—Mo1c—C5c—C4c25.6 (3)
C1b—Mo1b—S1b—C13b124.7 (3)C3c—Mo1c—C5c—C4c38.1 (1)
S3b—Mo1b—S1b—C13b167.0 (3)C2c—Mo1c—C5c—C4c80.1 (1)
S2b—Mo1b—S1b—C13b107.4 (3)C1c—Mo1c—C5c—C4c116.9 (1)
C11b—Mo1b—S1b—Mo2b88.2 (2)S3c—Mo1c—C5c—C4c173.2 (2)
C3b—Mo1b—S1b—Mo2b170.2 (2)S2c—Mo1c—C5c—C4c116.1 (2)
C4b—Mo1b—S1b—Mo2b159.1 (2)S1c—Mo1c—C5c—C4c103.4 (4)
C2b—Mo1b—S1b—Mo2b154.9 (2)C11c—Mo1c—C5c—C1c142.5 (3)
C5b—Mo1b—S1b—Mo2b142.7 (3)C3c—Mo1c—C5c—C1c78.8 (1)
C1b—Mo1b—S1b—Mo2b128.2 (2)C4c—Mo1c—C5c—C1c116.9 (1)
S3b—Mo1b—S1b—Mo2b59.9 (1)C2c—Mo1c—C5c—C1c36.8 (1)
S2b—Mo1b—S1b—Mo2b0.37 (7)S3c—Mo1c—C5c—C1c56.3 (2)
C12b—Mo2b—S2b—C20b18.3 (4)S2c—Mo1c—C5c—C1c127.0 (2)
C9b—Mo2b—S2b—C20b59.7 (3)S1c—Mo1c—C5c—C1c13.5 (4)
C8b—Mo2b—S2b—C20b50.8 (4)C12c—Mo2c—C6c—C10c52.5 (5)
C10b—Mo2b—S2b—C20b94.1 (3)C8c—Mo2c—C6c—C10c79.5 (1)
C7b—Mo2b—S2b—C20b112.3 (4)C9c—Mo2c—C6c—C10c37.3 (1)
C6b—Mo2b—S2b—C20b122.1 (3)C7c—Mo2c—C6c—C10c117.1 (1)
S3b—Mo2b—S2b—C20b168.6 (3)S3c—Mo2c—C6c—C10c124.9 (2)
S1b—Mo2b—S2b—C20b108.7 (3)S1c—Mo2c—C6c—C10c60.2 (2)
C12b—Mo2b—S2b—Mo1b90.0 (2)S2c—Mo2c—C6c—C10c171.8 (2)
C9b—Mo2b—S2b—Mo1b168.0 (1)C12c—Mo2c—C6c—C7c64.6 (5)
C8b—Mo2b—S2b—Mo1b159.1 (2)C8c—Mo2c—C6c—C7c37.7 (1)
C10b—Mo2b—S2b—Mo1b157.6 (2)C9c—Mo2c—C6c—C7c79.9 (1)
C7b—Mo2b—S2b—Mo1b139.4 (3)C10c—Mo2c—C6c—C7c117.1 (1)
C6b—Mo2b—S2b—Mo1b129.6 (1)S3c—Mo2c—C6c—C7c118.0 (2)
S3b—Mo2b—S2b—Mo1b60.3 (1)S1c—Mo2c—C6c—C7c177.4 (2)
S1b—Mo2b—S2b—Mo1b0.38 (7)S2c—Mo2c—C6c—C7c54.7 (2)
C11b—Mo1b—S2b—C20b16.3 (3)Mo2c—C6c—C7c—C8c62.8 (2)
C3b—Mo1b—S2b—C20b57.0 (4)C10c—C6c—C7c—Mo2c62.8 (2)
C4b—Mo1b—S2b—C20b59.0 (3)C12c—Mo2c—C7c—C8c19.5 (3)
C2b—Mo1b—S2b—C20b124.2 (4)C9c—Mo2c—C7c—C8c38.0 (1)
C5b—Mo1b—S2b—C20b91.0 (3)C10c—Mo2c—C7c—C8c79.6 (1)
C1b—Mo1b—S2b—C20b122.4 (3)C6c—Mo2c—C7c—C8c116.3 (1)
S3b—Mo1b—S2b—C20b166.4 (3)S3c—Mo2c—C7c—C8c178.1 (2)
S1b—Mo1b—S2b—C20b106.2 (3)S1c—Mo2c—C7c—C8c111.8 (3)
C11b—Mo1b—S2b—Mo2b89.6 (2)S2c—Mo2c—C7c—C8c111.1 (2)
C3b—Mo1b—S2b—Mo2b162.8 (2)C12c—Mo2c—C7c—C6c135.9 (3)
C4b—Mo1b—S2b—Mo2b164.9 (2)C8c—Mo2c—C7c—C6c116.3 (1)
C2b—Mo1b—S2b—Mo2b130.0 (2)C9c—Mo2c—C7c—C6c78.4 (1)
C5b—Mo1b—S2b—Mo2b163.1 (2)C10c—Mo2c—C7c—C6c36.7 (1)
C1b—Mo1b—S2b—Mo2b131.8 (2)S3c—Mo2c—C7c—C6c61.7 (2)
S3b—Mo1b—S2b—Mo2b60.52 (6)S1c—Mo2c—C7c—C6c4.5 (4)
S1b—Mo1b—S2b—Mo2b0.38 (7)S2c—Mo2c—C7c—C6c132.6 (2)
C11b—Mo1b—S3b—Mo2b3.0 (4)Mo2c—C7c—C8c—C9c64.7 (2)
C3b—Mo1b—S3b—Mo2b150.2 (2)C6c—C7c—C8c—Mo2c64.7 (2)
C4b—Mo1b—S3b—Mo2b159.2 (2)C12c—Mo2c—C8c—C9c82.5 (3)
C2b—Mo1b—S3b—Mo2b151.2 (1)C7c—Mo2c—C8c—C9c115.6 (1)
C5b—Mo1b—S3b—Mo2b149.5 (1)C10c—Mo2c—C8c—C9c37.4 (1)
C1b—Mo1b—S3b—Mo2b176.7 (2)C6c—Mo2c—C8c—C9c78.5 (1)
S1b—Mo1b—S3b—Mo2b60.1 (1)S3c—Mo2c—C8c—C9c112.9 (3)
S2b—Mo1b—S3b—Mo2b60.5 (1)S1c—Mo2c—C8c—C9c7.3 (3)
C12b—Mo2b—S3b—Mo1b1.1 (4)S2c—Mo2c—C8c—C9c170.0 (2)
C9b—Mo2b—S3b—Mo1b152.6 (2)C12c—Mo2c—C8c—C7c161.9 (3)
C8b—Mo2b—S3b—Mo1b155.5 (2)C9c—Mo2c—C8c—C7c115.6 (1)
C10b—Mo2b—S3b—Mo1b151.2 (2)C10c—Mo2c—C8c—C7c78.2 (1)
C7b—Mo2b—S3b—Mo1b149.0 (2)C6c—Mo2c—C8c—C7c37.1 (1)
C6b—Mo2b—S3b—Mo1b177.6 (2)S3c—Mo2c—C8c—C7c2.7 (3)
S2b—Mo2b—S3b—Mo1b61.15 (6)S1c—Mo2c—C8c—C7c122.9 (3)
S1b—Mo2b—S3b—Mo1b60.34 (6)S2c—Mo2c—C8c—C7c74.4 (2)
C11b—Mo1b—C1b—C5b45.5 (5)Mo2c—C8c—C9c—C10c65.3 (2)
C3b—Mo1b—C1b—C5b79.2 (1)C7c—C8c—C9c—Mo2c65.3 (2)
C4b—Mo1b—C1b—C5b37.1 (1)C12c—Mo2c—C9c—C8c89.9 (3)
C2b—Mo1b—C1b—C5b117.0 (1)C7c—Mo2c—C9c—C8c37.79 (8)
S3b—Mo1b—C1b—C5b129.2 (3)C10c—Mo2c—C9c—C8c115.9 (1)
S1b—Mo1b—C1b—C5b167.8 (2)C6c—Mo2c—C9c—C8c79.1 (1)
S2b—Mo1b—C1b—C5b64.7 (2)S3c—Mo2c—C9c—C8c105.2 (3)
C11b—Mo1b—C1b—C2b71.5 (5)S1c—Mo2c—C9c—C8c175.4 (2)
C3b—Mo1b—C1b—C2b37.8 (1)S2c—Mo2c—C9c—C8c15.2 (3)
C4b—Mo1b—C1b—C2b79.9 (1)C12c—Mo2c—C9c—C10c154.2 (3)
C5b—Mo1b—C1b—C2b117.0 (1)C8c—Mo2c—C9c—C10c115.9 (1)
S3b—Mo1b—C1b—C2b113.8 (3)C7c—Mo2c—C9c—C10c78.1 (1)
S1b—Mo1b—C1b—C2b50.8 (2)C6c—Mo2c—C9c—C10c36.8 (1)
S2b—Mo1b—C1b—C2b178.3 (2)S3c—Mo2c—C9c—C10c10.7 (3)
Mo1b—C1b—C2b—C3b63.2 (2)S1c—Mo2c—C9c—C10c68.7 (2)
C5b—C1b—C2b—Mo1b63.2 (2)S2c—Mo2c—C9c—C10c131.1 (3)
C11b—Mo1b—C2b—C1b131.6 (4)Mo2c—C6c—C10c—C9c62.2 (2)
C3b—Mo1b—C2b—C1b116.1 (1)C7c—C6c—C10c—Mo2c62.2 (2)
C4b—Mo1b—C2b—C1b78.2 (1)Mo2c—C9c—C10c—C6c63.7 (2)
C5b—Mo1b—C2b—C1b36.7 (1)C8c—C9c—C10c—Mo2c63.7 (2)
S3b—Mo1b—C2b—C1b65.1 (2)C12c—Mo2c—C10c—C6c143.6 (3)
S1b—Mo1b—C2b—C1b136.4 (2)C8c—Mo2c—C10c—C6c78.9 (1)
S2b—Mo1b—C2b—C1b2.8 (4)C9c—Mo2c—C10c—C6c116.8 (1)
C11b—Mo1b—C2b—C3b15.5 (4)C7c—Mo2c—C10c—C6c36.89 (8)
C4b—Mo1b—C2b—C3b37.92 (8)S3c—Mo2c—C10c—C6c55.7 (2)
C5b—Mo1b—C2b—C3b79.4 (1)S1c—Mo2c—C10c—C6c126.2 (2)
C1b—Mo1b—C2b—C3b116.1 (1)S2c—Mo2c—C10c—C6c15.0 (4)
S3b—Mo1b—C2b—C3b178.8 (2)C12c—Mo2c—C10c—C9c26.7 (3)
S1b—Mo1b—C2b—C3b107.5 (2)C8c—Mo2c—C10c—C9c37.9 (1)
S2b—Mo1b—C2b—C3b118.9 (4)C7c—Mo2c—C10c—C9c79.9 (1)
Mo1b—C2b—C3b—C4b65.1 (2)C6c—Mo2c—C10c—C9c116.8 (1)
C1b—C2b—C3b—Mo1b65.1 (2)S3c—Mo2c—C10c—C9c172.5 (2)
C11b—Mo1b—C3b—C4b78.4 (3)S1c—Mo2c—C10c—C9c117.0 (2)
C2b—Mo1b—C3b—C4b115.6 (1)S2c—Mo2c—C10c—C9c101.9 (4)
C5b—Mo1b—C3b—C4b37.3 (1)Mo2c—S1c—C13c—C14c71.6 (6)
C1b—Mo1b—C3b—C4b78.4 (1)Mo1c—S1c—C13c—C14c147.7 (4)
S3b—Mo1b—C3b—C4b117.2 (3)S1c—C13c—C14c—C15c61.1 (7)
S1b—Mo1b—C3b—C4b167.1 (2)S1c—C13c—C14c—C19c118.2 (5)
S2b—Mo1b—C3b—C4b3.3 (4)C13c—C14c—C15c—C16c179.3 (6)
C11b—Mo1b—C3b—C2b166.0 (3)C13c—C14c—C19c—C18c179.3 (6)
C4b—Mo1b—C3b—C2b115.6 (1)Mo1c—S2c—C20c—C21c68.9 (6)
C5b—Mo1b—C3b—C2b78.3 (1)Mo2c—S2c—C20c—C21c144.8 (5)
C1b—Mo1b—C3b—C2b37.2 (1)S2c—C20c—C21c—C22c54.9 (7)
S3b—Mo1b—C3b—C2b1.6 (3)S2c—C20c—C21c—C26c125.9 (5)
S1b—Mo1b—C3b—C2b77.3 (2)C20c—C21c—C22c—C23c179.2 (6)
S2b—Mo1b—C3b—C2b118.8 (4)C20c—C21c—C26c—C25c179.2 (6)
Mo1b—C3b—C4b—C5b65.2 (2)
 

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