NBH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C10 | doub | 1.38Å | 1.42Å | Aromatic |
| C11 | C06 | sing | 1.38Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.51Å | 1.48Å | |
| C05 | N04 | sing | 1.47Å | 1.48Å | |
| C10 | C09 | sing | 1.38Å | 1.42Å | Aromatic |
| C03 | N04 | sing | 1.47Å | 1.45Å | |
| C03 | C02 | sing | 1.53Å | 1.61Å | |
| C06 | C07 | doub | 1.38Å | 1.42Å | Aromatic |
| C12 | N04 | sing | 1.47Å | 1.49Å | |
| C12 | C13 | sing | 1.51Å | 1.53Å | |
| C33 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.38Å | Aromatic |
| C02 | C01 | sing | 1.53Å | 1.51Å | |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C09 | C08 | doub | 1.38Å | 1.37Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.42Å | Aromatic |
| C32 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | N17 | sing | 1.40Å | 1.42Å | |
| N17 | C18 | sing | 1.35Å | 1.44Å | |
| C18 | O19 | doub | 1.21Å | 1.19Å | |
| C18 | C20 | sing | 1.51Å | 1.50Å | |
| C22 | C23 | doub | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C23 | C24 | sing | 1.38Å | 1.42Å | Aromatic |
| C21 | C26 | doub | 1.38Å | 1.43Å | Aromatic |
| O28 | S27 | doub | 1.42Å | 1.44Å | |
| C24 | S27 | sing | 1.76Å | 1.75Å | |
| C24 | C25 | doub | 1.38Å | 1.42Å | Aromatic |
| C31 | C30 | sing | 1.53Å | 1.56Å | |
| C26 | C25 | sing | 1.38Å | 1.41Å | Aromatic |
| S27 | C30 | sing | 1.81Å | 1.83Å | |
| S27 | O29 | doub | 1.42Å | 1.45Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C03 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H9 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C07 | H11 | sing | 1.08Å | 1.08Å | |
| C08 | H12 | sing | 1.08Å | 1.08Å | |
| C09 | H13 | sing | 1.08Å | 1.08Å | |
| C10 | H14 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.08Å | 1.08Å | |
| C15 | H19 | sing | 1.08Å | 1.08Å | |
| N17 | H20 | sing | 0.97Å | 1.00Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.08Å | 1.08Å | |
| C23 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C11 | C06 | 120.1° | 120.0° |
| C11 | C10 | C09 | 120.2° | 120.0° |
| C11 | C10 | H14 | 119.9° | 120.0° |
| C10 | C11 | H15 | 119.9° | 120.0° |
| C11 | C06 | C05 | 121.1° | 120.0° |
| C11 | C06 | C07 | 119.8° | 120.0° |
| C06 | C11 | H15 | 120.0° | 120.0° |
| C06 | C05 | N04 | 117.0° | 109.5° |
| C05 | C06 | C07 | 119.1° | 120.0° |
| C06 | C05 | H9 | 107.6° | 109.5° |
| C06 | C05 | H10 | 107.6° | 109.4° |
| C05 | N04 | C03 | 112.1° | 111.0° |
| C05 | N04 | C12 | 113.5° | 111.0° |
| N04 | C05 | H9 | 107.6° | 109.5° |
| N04 | C05 | H10 | 107.6° | 109.5° |
| C10 | C09 | C08 | 119.7° | 120.0° |
| C10 | C09 | H13 | 120.1° | 120.0° |
| C09 | C10 | H14 | 119.9° | 120.0° |
| N04 | C03 | C02 | 117.4° | 109.5° |
| C03 | N04 | C12 | 112.8° | 111.0° |
| N04 | C03 | H6 | 107.4° | 109.5° |
| N04 | C03 | H7 | 107.4° | 109.5° |
| C03 | C02 | C01 | 116.4° | 109.5° |
| C03 | C02 | H4 | 107.7° | 109.5° |
| C03 | C02 | H5 | 107.7° | 109.5° |
| C02 | C03 | H6 | 107.5° | 109.4° |
| C02 | C03 | H7 | 107.5° | 109.4° |
| C06 | C07 | C08 | 120.1° | 120.0° |
| C06 | C07 | H11 | 120.0° | 120.0° |
| N04 | C12 | C13 | 116.3° | 109.5° |
| N04 | C12 | H16 | 107.7° | 109.5° |
| N04 | C12 | H17 | 107.7° | 109.4° |
| C12 | C13 | C33 | 119.6° | 119.9° |
| C12 | C13 | C14 | 120.6° | 120.0° |
| C13 | C12 | H16 | 107.7° | 109.5° |
| C13 | C12 | H17 | 107.7° | 109.5° |
| C13 | C33 | C32 | 119.9° | 120.1° |
| C33 | C13 | C14 | 119.9° | 120.1° |
| C13 | C33 | H33 | 120.0° | 119.9° |
| C33 | C32 | C16 | 120.8° | 119.9° |
| C33 | C32 | H32 | 119.6° | 120.1° |
| C32 | C33 | H33 | 120.1° | 120.0° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.4° | 109.4° |
| C02 | C01 | H3 | 109.4° | 109.5° |
| C01 | C02 | H4 | 107.7° | 109.4° |
| C01 | C02 | H5 | 107.7° | 109.5° |
| C13 | C14 | C15 | 120.3° | 120.1° |
| C13 | C14 | H18 | 119.8° | 119.9° |
| C09 | C08 | C07 | 120.1° | 120.0° |
| C09 | C08 | H12 | 119.9° | 120.0° |
| C08 | C09 | H13 | 120.1° | 120.0° |
| C08 | C07 | H11 | 119.9° | 120.0° |
| C07 | C08 | H12 | 120.0° | 120.0° |
| C32 | C16 | C15 | 118.8° | 119.9° |
| C32 | C16 | N17 | 116.8° | 120.0° |
| C16 | C32 | H32 | 119.6° | 120.1° |
| C14 | C15 | C16 | 120.3° | 119.9° |
| C15 | C14 | H18 | 119.8° | 120.0° |
| C14 | C15 | H19 | 119.9° | 120.1° |
| C15 | C16 | N17 | 124.4° | 120.1° |
| C16 | C15 | H19 | 119.8° | 120.0° |
| C16 | N17 | C18 | 126.0° | 120.0° |
| C16 | N17 | H20 | 117.0° | 120.0° |
| N17 | C18 | O19 | 123.7° | 120.0° |
| N17 | C18 | C20 | 118.4° | 120.0° |
| C18 | N17 | H20 | 117.0° | 120.0° |
| O19 | C18 | C20 | 117.8° | 120.0° |
| C18 | C20 | C21 | 109.8° | 109.4° |
| C18 | C20 | H21 | 109.4° | 109.4° |
| C18 | C20 | H22 | 109.4° | 109.4° |
| C23 | C22 | C21 | 119.8° | 120.0° |
| C22 | C23 | C24 | 119.4° | 120.0° |
| C23 | C22 | H23 | 120.1° | 120.0° |
| C22 | C23 | H24 | 120.3° | 120.0° |
| C22 | C21 | C20 | 118.5° | 120.0° |
| C22 | C21 | C26 | 121.0° | 120.0° |
| C21 | C22 | H23 | 120.1° | 120.0° |
| C20 | C21 | C26 | 120.5° | 120.0° |
| C21 | C20 | H21 | 109.4° | 109.5° |
| C21 | C20 | H22 | 109.4° | 109.5° |
| C23 | C24 | S27 | 120.8° | 120.0° |
| C23 | C24 | C25 | 120.6° | 120.0° |
| C24 | C23 | H24 | 120.3° | 120.0° |
| C21 | C26 | C25 | 119.0° | 120.0° |
| C21 | C26 | H26 | 120.5° | 120.0° |
| O28 | S27 | C24 | 113.3° | 104.3° |
| O28 | S27 | C30 | 110.7° | 110.6° |
| O28 | S27 | O29 | 103.9° | 121.0° |
| S27 | C24 | C25 | 118.6° | 120.0° |
| C24 | S27 | C30 | 107.4° | 104.4° |
| C24 | S27 | O29 | 109.4° | 104.3° |
| C24 | C25 | C26 | 120.2° | 120.0° |
| C24 | C25 | H25 | 119.9° | 120.0° |
| C31 | C30 | S27 | 118.6° | 109.5° |
| C31 | C30 | H27 | 107.1° | 109.5° |
| C31 | C30 | H28 | 107.2° | 109.4° |
| C30 | C31 | H29 | 109.5° | 109.5° |
| C30 | C31 | H30 | 109.4° | 109.5° |
| C30 | C31 | H31 | 109.4° | 109.4° |
| C26 | C25 | H25 | 119.9° | 120.0° |
| C25 | C26 | H26 | 120.5° | 120.0° |
| C30 | S27 | O29 | 112.1° | 110.6° |
| S27 | C30 | H27 | 107.2° | 109.5° |
| S27 | C30 | H28 | 107.2° | 109.5° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H4 | C02 | H5 | 109.4° | 109.4° |
| H6 | C03 | H7 | 109.5° | 109.5° |
| H9 | C05 | H10 | 109.5° | 109.5° |
| H16 | C12 | H17 | 109.5° | 109.5° |
| H21 | C20 | H22 | 109.5° | 109.5° |
| H27 | C30 | H28 | 109.4° | 109.5° |
| H29 | C31 | H30 | 109.5° | 109.5° |
| H29 | C31 | H31 | 109.5° | 109.5° |
| H30 | C31 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C11 | C06 | H15 | 180.0° | 179.5° |
| C10 | C11 | C06 | C05 | 180.0° | 179.7° |
| C11 | C10 | C09 | H14 | 180.0° | 179.9° |
| C10 | C11 | C06 | C07 | 0.2° | 0.5° |
| C11 | C10 | C09 | C08 | 0.1° | 0.2° |
| C11 | C10 | C09 | H13 | 179.9° | 179.8° |
| C11 | C06 | C05 | C07 | 179.7° | 179.7° |
| C11 | C06 | C05 | N04 | 143.2° | 90.3° |
| C06 | C11 | C10 | C09 | 0.1° | 0.5° |
| C11 | C06 | C07 | C08 | 0.2° | 0.3° |
| C11 | C06 | C05 | H9 | 22.1° | 149.7° |
| C11 | C06 | C05 | H10 | 95.7° | 29.7° |
| C11 | C06 | C07 | H11 | 179.8° | 179.8° |
| C06 | C11 | C10 | H14 | 179.9° | 179.7° |
| C06 | C05 | N04 | H9 | 121.1° | 120.0° |
| C06 | C05 | N04 | H10 | 121.1° | 120.0° |
| C06 | C05 | N04 | C03 | 152.1° | 66.0° |
| C06 | C05 | N04 | C12 | 78.7° | 170.0° |
| C05 | C06 | C07 | C08 | 179.9° | 180.0° |
| C06 | C05 | H9 | H10 | 116.6° | 120.0° |
| C05 | C06 | C07 | H11 | 0.1° | 0.1° |
| C05 | C06 | C11 | H15 | 0.0° | 0.3° |
| C05 | N04 | C03 | C12 | 129.6° | 123.9° |
| C05 | N04 | C03 | C02 | 81.6° | 163.8° |
| N04 | C05 | C06 | C07 | 36.5° | 90.0° |
| C05 | N04 | C12 | C13 | 166.1° | 71.8° |
| C05 | N04 | C03 | H6 | 157.3° | 43.8° |
| C05 | N04 | C03 | H7 | 39.6° | 76.2° |
| N04 | C05 | H9 | H10 | 116.6° | 120.0° |
| C05 | N04 | C12 | H16 | 45.1° | 48.2° |
| C05 | N04 | C12 | H17 | 72.9° | 168.2° |
| C10 | C09 | C08 | H13 | 180.0° | 179.9° |
| C10 | C09 | C08 | C07 | 0.1° | 0.1° |
| C10 | C09 | C08 | H12 | 179.9° | 179.9° |
| C09 | C10 | C11 | H15 | 179.9° | 179.9° |
| N04 | C03 | C02 | H6 | 121.1° | 120.0° |
| N04 | C03 | C02 | H7 | 121.1° | 120.0° |
| C03 | N04 | C12 | C13 | 65.0° | 164.3° |
| N04 | C03 | C02 | C01 | 78.5° | 179.4° |
| N04 | C03 | C02 | H4 | 160.5° | 60.6° |
| N04 | C03 | C02 | H5 | 42.5° | 59.4° |
| N04 | C03 | H6 | H7 | 116.4° | 120.1° |
| C03 | N04 | C05 | H9 | 86.9° | 54.0° |
| C03 | N04 | C05 | H10 | 31.0° | 174.0° |
| C03 | N04 | C12 | H16 | 174.0° | 75.7° |
| C03 | N04 | C12 | H17 | 56.0° | 44.3° |
| C02 | C03 | N04 | C12 | 148.8° | 72.3° |
| C03 | C02 | C01 | H4 | 121.0° | 120.0° |
| C03 | C02 | C01 | H5 | 121.0° | 120.0° |
| C03 | C02 | C01 | H1 | 180.0° | 60.0° |
| C03 | C02 | C01 | H2 | 60.0° | 60.0° |
| C03 | C02 | C01 | H3 | 60.0° | 180.0° |
| C03 | C02 | H4 | H5 | 116.9° | 120.0° |
| C02 | C03 | H6 | H7 | 116.4° | 119.9° |
| C06 | C07 | C08 | C09 | 0.0° | 0.0° |
| C06 | C07 | C08 | H11 | 180.0° | 179.9° |
| C07 | C06 | C05 | H9 | 157.6° | 30.0° |
| C07 | C06 | C05 | H10 | 84.6° | 150.0° |
| C06 | C07 | C08 | H12 | 180.0° | 180.0° |
| C07 | C06 | C11 | H15 | 179.7° | 180.0° |
| N04 | C12 | C13 | H16 | 121.0° | 120.0° |
| N04 | C12 | C13 | H17 | 121.0° | 119.9° |
| N04 | C12 | C13 | C33 | 107.6° | 84.2° |
| N04 | C12 | C13 | C14 | 71.1° | 96.0° |
| C12 | N04 | C03 | H6 | 27.7° | 167.8° |
| C12 | N04 | C03 | H7 | 90.0° | 47.7° |
| C12 | N04 | C05 | H9 | 42.4° | 70.0° |
| C12 | N04 | C05 | H10 | 160.3° | 50.0° |
| N04 | C12 | H16 | H17 | 116.9° | 120.0° |
| C12 | C13 | C33 | C14 | 178.7° | 179.8° |
| C12 | C13 | C33 | C32 | 179.8° | 179.8° |
| C12 | C13 | C14 | C15 | 179.6° | 180.0° |
| C13 | C12 | H16 | H17 | 116.9° | 120.0° |
| C12 | C13 | C14 | H18 | 0.4° | 0.0° |
| C12 | C13 | C33 | H33 | 0.2° | 0.0° |
| C13 | C33 | C32 | H33 | 180.0° | 179.8° |
| C13 | C33 | C32 | C16 | 0.7° | 0.5° |
| C33 | C13 | C14 | C15 | 0.9° | 0.2° |
| C33 | C13 | C12 | H16 | 131.4° | 155.8° |
| C33 | C13 | C12 | H17 | 13.4° | 35.7° |
| C33 | C13 | C14 | H18 | 179.1° | 179.8° |
| C13 | C33 | C32 | H32 | 179.3° | 179.8° |
| C32 | C33 | C13 | C14 | 1.1° | 0.5° |
| C33 | C32 | C16 | H32 | 180.0° | 179.8° |
| C33 | C32 | C16 | C15 | 0.2° | 0.3° |
| C33 | C32 | C16 | N17 | 179.7° | 179.7° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 120.1° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | H4 | H5 | 116.9° | 120.0° |
| C01 | C02 | C03 | H6 | 42.7° | 59.4° |
| C01 | C02 | C03 | H7 | 160.4° | 60.6° |
| C13 | C14 | C15 | H18 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.4° | 0.0° |
| C14 | C13 | C12 | H16 | 49.9° | 24.0° |
| C14 | C13 | C12 | H17 | 167.9° | 144.0° |
| C13 | C14 | C15 | H19 | 179.6° | 180.0° |
| C14 | C13 | C33 | H33 | 178.9° | 179.7° |
| C09 | C08 | C07 | H12 | 180.0° | 180.0° |
| C09 | C08 | C07 | H11 | 180.0° | 179.9° |
| C08 | C09 | C10 | H14 | 179.9° | 180.0° |
| C07 | C08 | C09 | H13 | 179.9° | 180.0° |
| C32 | C16 | C15 | C14 | 0.1° | 0.0° |
| C32 | C16 | C15 | N17 | 179.4° | 180.0° |
| C32 | C16 | N17 | C18 | 164.4° | 145.6° |
| C32 | C16 | C15 | H19 | 180.0° | 180.0° |
| C32 | C16 | N17 | H20 | 15.6° | 34.4° |
| C16 | C32 | C33 | H33 | 179.3° | 179.7° |
| C14 | C15 | C16 | H19 | 180.0° | 180.0° |
| C14 | C15 | C16 | N17 | 179.5° | 180.0° |
| C15 | C16 | N17 | C18 | 16.2° | 34.3° |
| C16 | C15 | C14 | H18 | 179.6° | 180.0° |
| C15 | C16 | N17 | H20 | 163.8° | 145.6° |
| C15 | C16 | C32 | H32 | 179.8° | 180.0° |
| C16 | N17 | C18 | H20 | 180.0° | 179.9° |
| C16 | N17 | C18 | O19 | 2.1° | 5.0° |
| C16 | N17 | C18 | C20 | 179.2° | 175.1° |
| N17 | C16 | C15 | H19 | 0.5° | 0.1° |
| N17 | C16 | C32 | H32 | 0.3° | 0.0° |
| N17 | C18 | O19 | C20 | 177.1° | 179.9° |
| N17 | C18 | C20 | C21 | 103.7° | 179.9° |
| N17 | C18 | C20 | H21 | 136.2° | 59.9° |
| N17 | C18 | C20 | H22 | 16.3° | 60.1° |
| O19 | C18 | C20 | C21 | 73.5° | 0.0° |
| O19 | C18 | N17 | H20 | 177.9° | 175.1° |
| O19 | C18 | C20 | H21 | 46.5° | 120.0° |
| O19 | C18 | C20 | H22 | 166.4° | 120.0° |
| C18 | C20 | C21 | C22 | 64.1° | 89.8° |
| C18 | C20 | C21 | H21 | 120.0° | 120.0° |
| C18 | C20 | C21 | H22 | 120.0° | 120.0° |
| C18 | C20 | C21 | C26 | 113.4° | 90.1° |
| C20 | C18 | N17 | H20 | 0.9° | 4.8° |
| C18 | C20 | H21 | H22 | 119.8° | 120.0° |
| C23 | C22 | C21 | H23 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 178.9° | 179.9° |
| C22 | C23 | C24 | H24 | 180.0° | 179.9° |
| C23 | C22 | C21 | C26 | 1.4° | 0.3° |
| C22 | C23 | C24 | S27 | 179.4° | 180.0° |
| C22 | C23 | C24 | C25 | 0.7° | 0.0° |
| C22 | C21 | C20 | C26 | 177.5° | 179.8° |
| C21 | C22 | C23 | C24 | 0.3° | 0.0° |
| C22 | C21 | C26 | C25 | 1.5° | 0.5° |
| C22 | C21 | C20 | H21 | 175.9° | 150.3° |
| C22 | C21 | C20 | H22 | 55.9° | 30.2° |
| C21 | C22 | C23 | H24 | 179.7° | 180.0° |
| C22 | C21 | C26 | H26 | 178.5° | 179.8° |
| C20 | C21 | C26 | C25 | 178.9° | 179.7° |
| C21 | C20 | H21 | H22 | 119.9° | 120.1° |
| C20 | C21 | C22 | H23 | 1.1° | 0.0° |
| C20 | C21 | C26 | H26 | 1.1° | 0.0° |
| C23 | C24 | S27 | O28 | 25.2° | 153.9° |
| C23 | C24 | S27 | C25 | 178.7° | 180.0° |
| C23 | C24 | C25 | C26 | 0.6° | 0.3° |
| C23 | C24 | S27 | C30 | 97.4° | 90.0° |
| C23 | C24 | S27 | O29 | 140.7° | 26.1° |
| C24 | C23 | C22 | H23 | 179.7° | 180.0° |
| C23 | C24 | C25 | H25 | 179.4° | 179.9° |
| C21 | C26 | C25 | C24 | 0.5° | 0.5° |
| C21 | C26 | C25 | H26 | 180.0° | 179.8° |
| C26 | C21 | C20 | H21 | 6.7° | 29.9° |
| C26 | C21 | C20 | H22 | 126.6° | 150.0° |
| C26 | C21 | C22 | H23 | 178.6° | 179.8° |
| C21 | C26 | C25 | H25 | 179.5° | 179.7° |
| O28 | S27 | C24 | C30 | 122.6° | 116.1° |
| O28 | S27 | C24 | O29 | 115.5° | 127.8° |
| O28 | S27 | C24 | C25 | 156.1° | 26.1° |
| O28 | S27 | C30 | C31 | 82.6° | 68.4° |
| O28 | S27 | C30 | O29 | 115.5° | 136.7° |
| O28 | S27 | C30 | H27 | 38.7° | 171.6° |
| O28 | S27 | C30 | H28 | 156.1° | 51.6° |
| C24 | S27 | C30 | C31 | 41.6° | 180.0° |
| S27 | C24 | C25 | C26 | 179.3° | 179.8° |
| C24 | S27 | C30 | O29 | 120.2° | 111.7° |
| S27 | C24 | C23 | H24 | 0.6° | 0.1° |
| S27 | C24 | C25 | H25 | 0.7° | 0.0° |
| C24 | S27 | C30 | H27 | 162.9° | 60.0° |
| C24 | S27 | C30 | H28 | 79.7° | 60.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C25 | C24 | S27 | C30 | 81.2° | 90.0° |
| C25 | C24 | S27 | O29 | 40.7° | 153.9° |
| C25 | C24 | C23 | H24 | 179.3° | 180.0° |
| C24 | C25 | C26 | H26 | 179.5° | 179.8° |
| C31 | C30 | S27 | H27 | 121.3° | 120.0° |
| C31 | C30 | S27 | H28 | 121.3° | 120.0° |
| C31 | C30 | S27 | O29 | 161.8° | 68.4° |
| C31 | C30 | H27 | H28 | 115.9° | 120.0° |
| C30 | C31 | H29 | H30 | 120.0° | 120.0° |
| C30 | C31 | H29 | H31 | 120.0° | 120.0° |
| C30 | C31 | H30 | H31 | 120.0° | 120.0° |
| S27 | C30 | H27 | H28 | 115.9° | 120.0° |
| S27 | C30 | C31 | H29 | 180.0° | 180.0° |
| S27 | C30 | C31 | H30 | 60.0° | 60.0° |
| S27 | C30 | C31 | H31 | 60.0° | 60.0° |
| O29 | S27 | C30 | H27 | 76.9° | 51.6° |
| O29 | S27 | C30 | H28 | 40.5° | 171.6° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H1 | C01 | C02 | H4 | 59.0° | 60.0° |
| H1 | C01 | C02 | H5 | 59.0° | 180.0° |
| H2 | C01 | C02 | H4 | 179.0° | 180.0° |
| H2 | C01 | C02 | H5 | 61.0° | 60.0° |
| H3 | C01 | C02 | H4 | 61.0° | 60.1° |
| H3 | C01 | C02 | H5 | 179.0° | 59.9° |
| H4 | C02 | C03 | H6 | 78.4° | 179.3° |
| H4 | C02 | C03 | H7 | 39.4° | 59.4° |
| H5 | C02 | C03 | H6 | 163.7° | 60.7° |
| H5 | C02 | C03 | H7 | 78.6° | 179.3° |
| H11 | C07 | C08 | H12 | 0.0° | 0.1° |
| H12 | C08 | C09 | H13 | 0.1° | 0.0° |
| H13 | C09 | C10 | H14 | 0.1° | 0.1° |
| H14 | C10 | C11 | H15 | 0.1° | 0.2° |
| H18 | C14 | C15 | H19 | 0.4° | 0.0° |
| H23 | C22 | C23 | H24 | 0.3° | 0.1° |
| H25 | C25 | C26 | H26 | 0.5° | 0.0° |
| H27 | C30 | C31 | H29 | 58.7° | 59.9° |
| H27 | C30 | C31 | H30 | 61.3° | 180.0° |
| H27 | C30 | C31 | H31 | 178.7° | 60.0° |
| H28 | C30 | C31 | H29 | 58.7° | 60.0° |
| H28 | C30 | C31 | H30 | 178.7° | 60.0° |
| H28 | C30 | C31 | H31 | 61.4° | 180.0° |
| H29 | C31 | H30 | H31 | 120.0° | 120.0° |
| H32 | C32 | C33 | H33 | 0.7° | 0.0° |
