R0Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| O13 | C12 | doub | 1.22Å | 1.17Å | |
| C16 | C17 | doub | 1.39Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.48Å | 1.49Å | |
| C11 | C10 | doub | 1.41Å | 1.34Å | Aromatic |
| C12 | C07 | sing | 1.48Å | 1.48Å | |
| C17 | C10 | sing | 1.41Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.47Å | 1.51Å | |
| C10 | N09 | sing | 1.37Å | 1.48Å | |
| C07 | C06 | doub | 1.40Å | 1.39Å | Aromatic |
| C07 | C08 | sing | 1.41Å | 1.34Å | Aromatic |
| C06 | C05 | sing | 1.38Å | 1.37Å | Aromatic |
| N20 | C18 | sing | 1.35Å | 1.45Å | |
| N20 | C21 | sing | 1.40Å | 1.46Å | |
| C18 | O19 | doub | 1.22Å | 1.15Å | |
| N09 | C08 | sing | 1.38Å | 1.50Å | |
| C08 | C03 | doub | 1.40Å | 1.40Å | Aromatic |
| C05 | C04 | doub | 1.39Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.37Å | Aromatic |
| C21 | C26 | sing | 1.39Å | 1.37Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.37Å | Aromatic |
| C03 | C04 | sing | 1.38Å | 1.37Å | Aromatic |
| C03 | O02 | sing | 1.36Å | 1.37Å | |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| O02 | C01 | sing | 1.43Å | 1.39Å | |
| C25 | C24 | sing | 1.38Å | 1.37Å | Aromatic |
| C24 | C27 | sing | 1.51Å | 1.54Å | |
| C40 | O39 | sing | 1.43Å | 1.40Å | |
| C27 | C28 | sing | 1.53Å | 1.56Å | |
| C38 | C37 | sing | 1.51Å | 1.48Å | |
| C38 | N29 | sing | 1.47Å | 1.35Å | |
| C36 | C37 | doub | 1.39Å | 1.43Å | Aromatic |
| C36 | C35 | sing | 1.38Å | 1.36Å | Aromatic |
| O39 | C35 | sing | 1.36Å | 1.40Å | |
| C28 | N29 | sing | 1.47Å | 1.27Å | |
| C37 | C32 | sing | 1.38Å | 1.26Å | Aromatic |
| C35 | C34 | doub | 1.39Å | 1.36Å | Aromatic |
| N29 | C30 | sing | 1.47Å | 1.39Å | |
| C30 | C31 | sing | 1.53Å | 1.57Å | |
| C32 | C31 | sing | 1.51Å | 1.53Å | |
| C32 | C33 | doub | 1.39Å | 1.43Å | Aromatic |
| C34 | C33 | sing | 1.38Å | 1.37Å | Aromatic |
| C34 | O41 | sing | 1.36Å | 1.39Å | |
| O41 | C42 | sing | 1.43Å | 1.38Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C22 | H2 | sing | 1.08Å | 1.08Å | |
| C26 | H3 | sing | 1.08Å | 1.08Å | |
| C28 | H4 | sing | 1.09Å | 1.10Å | |
| C28 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C04 | H9 | sing | 1.08Å | 1.08Å | |
| C05 | H10 | sing | 1.08Å | 1.08Å | |
| C06 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H13 | sing | 1.08Å | 1.08Å | |
| C23 | H14 | sing | 1.08Å | 1.08Å | |
| C25 | H15 | sing | 1.08Å | 1.08Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C30 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C31 | H20 | sing | 1.09Å | 1.10Å | |
| C31 | H21 | sing | 1.09Å | 1.10Å | |
| C33 | H22 | sing | 1.08Å | 1.08Å | |
| C36 | H23 | sing | 1.08Å | 1.08Å | |
| C38 | H24 | sing | 1.09Å | 1.10Å | |
| C38 | H25 | sing | 1.09Å | 1.10Å | |
| C40 | H26 | sing | 1.09Å | 1.10Å | |
| C40 | H27 | sing | 1.09Å | 1.10Å | |
| C40 | H28 | sing | 1.09Å | 1.10Å | |
| C42 | H29 | sing | 1.09Å | 1.10Å | |
| C42 | H30 | sing | 1.09Å | 1.10Å | |
| C42 | H31 | sing | 1.09Å | 1.10Å | |
| N09 | H32 | sing | 0.97Å | 1.00Å | |
| N20 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C15 | C16 | 119.9° | 120.5° |
| C15 | C14 | C11 | 119.8° | 120.0° |
| C14 | C15 | H1 | 120.0° | 119.8° |
| C15 | C14 | H12 | 120.1° | 120.0° |
| C15 | C16 | C17 | 118.6° | 120.5° |
| C16 | C15 | H1 | 120.0° | 119.7° |
| C15 | C16 | H13 | 120.7° | 119.7° |
| C14 | C11 | C12 | 120.2° | 121.0° |
| C14 | C11 | C10 | 120.3° | 120.3° |
| C11 | C14 | H12 | 120.1° | 120.0° |
| O13 | C12 | C11 | 121.2° | 121.6° |
| O13 | C12 | C07 | 119.6° | 121.6° |
| C16 | C17 | C10 | 121.7° | 119.6° |
| C16 | C17 | C18 | 121.6° | 120.2° |
| C17 | C16 | H13 | 120.7° | 119.7° |
| C12 | C11 | C10 | 119.5° | 118.8° |
| C11 | C12 | C07 | 119.2° | 116.9° |
| C11 | C10 | C17 | 119.7° | 119.1° |
| C11 | C10 | N09 | 121.7° | 120.6° |
| C12 | C07 | C06 | 117.9° | 121.0° |
| C12 | C07 | C08 | 121.3° | 118.8° |
| C10 | C17 | C18 | 116.6° | 120.2° |
| C17 | C10 | N09 | 118.6° | 120.4° |
| C17 | C18 | N20 | 120.2° | 120.0° |
| C17 | C18 | O19 | 118.0° | 120.0° |
| C10 | N09 | C08 | 118.6° | 121.8° |
| C10 | N09 | H32 | 120.7° | 119.0° |
| C06 | C07 | C08 | 120.8° | 120.2° |
| C07 | C06 | C05 | 119.6° | 119.7° |
| C07 | C06 | H11 | 120.2° | 120.2° |
| C07 | C08 | N09 | 119.6° | 120.4° |
| C07 | C08 | C03 | 119.3° | 119.2° |
| C06 | C05 | C04 | 120.2° | 120.4° |
| C06 | C05 | H10 | 119.9° | 119.8° |
| C05 | C06 | H11 | 120.2° | 120.2° |
| C18 | N20 | C21 | 114.3° | 120.0° |
| N20 | C18 | O19 | 121.7° | 120.0° |
| C18 | N20 | H33 | 122.8° | 120.0° |
| N20 | C21 | C22 | 115.8° | 120.1° |
| N20 | C21 | C26 | 122.7° | 120.0° |
| C21 | N20 | H33 | 122.9° | 119.9° |
| N09 | C08 | C03 | 121.1° | 120.4° |
| C08 | N09 | H32 | 120.7° | 119.1° |
| C08 | C03 | C04 | 120.9° | 119.9° |
| C08 | C03 | O02 | 122.2° | 120.1° |
| C05 | C04 | C03 | 119.3° | 120.7° |
| C05 | C04 | H9 | 120.4° | 119.7° |
| C04 | C05 | H10 | 119.9° | 119.8° |
| C22 | C21 | C26 | 121.4° | 119.9° |
| C21 | C22 | C23 | 119.2° | 119.9° |
| C21 | C22 | H2 | 120.4° | 120.0° |
| C21 | C26 | C25 | 119.5° | 119.9° |
| C21 | C26 | H3 | 120.3° | 120.0° |
| C22 | C23 | C24 | 120.0° | 120.1° |
| C23 | C22 | H2 | 120.4° | 120.0° |
| C22 | C23 | H14 | 120.0° | 120.0° |
| C04 | C03 | O02 | 116.9° | 120.1° |
| C03 | C04 | H9 | 120.3° | 119.6° |
| C03 | O02 | C01 | 110.4° | 117.0° |
| C26 | C25 | C24 | 118.7° | 120.1° |
| C25 | C26 | H3 | 120.2° | 120.1° |
| C26 | C25 | H15 | 120.7° | 119.9° |
| C23 | C24 | C25 | 121.2° | 120.1° |
| C23 | C24 | C27 | 115.7° | 120.0° |
| C24 | C23 | H14 | 120.0° | 119.9° |
| O02 | C01 | H6 | 109.5° | 109.5° |
| O02 | C01 | H7 | 109.5° | 109.5° |
| O02 | C01 | H8 | 109.4° | 109.4° |
| C25 | C24 | C27 | 123.1° | 119.9° |
| C24 | C25 | H15 | 120.7° | 120.0° |
| C24 | C27 | C28 | 105.5° | 109.5° |
| C24 | C27 | H16 | 110.5° | 109.5° |
| C24 | C27 | H17 | 110.5° | 109.4° |
| C40 | O39 | C35 | 110.7° | 117.0° |
| O39 | C40 | H26 | 109.5° | 109.4° |
| O39 | C40 | H27 | 109.5° | 109.5° |
| O39 | C40 | H28 | 109.5° | 109.5° |
| C27 | C28 | N29 | 110.9° | 109.5° |
| C27 | C28 | H4 | 109.1° | 109.4° |
| C27 | C28 | H5 | 109.1° | 109.4° |
| C28 | C27 | H16 | 110.4° | 109.5° |
| C28 | C27 | H17 | 110.5° | 109.5° |
| C37 | C38 | N29 | 103.0° | 110.5° |
| C38 | C37 | C36 | 119.1° | 118.3° |
| C38 | C37 | C32 | 117.5° | 121.8° |
| C37 | C38 | H24 | 111.1° | 109.3° |
| C37 | C38 | H25 | 111.1° | 109.2° |
| C38 | N29 | C28 | 111.9° | 111.0° |
| C38 | N29 | C30 | 107.5° | 110.3° |
| N29 | C38 | H24 | 111.0° | 109.3° |
| N29 | C38 | H25 | 111.0° | 109.3° |
| C37 | C36 | C35 | 117.7° | 120.4° |
| C36 | C37 | C32 | 123.4° | 119.9° |
| C37 | C36 | H23 | 121.1° | 119.8° |
| C36 | C35 | O39 | 117.3° | 120.1° |
| C36 | C35 | C34 | 120.2° | 119.7° |
| C35 | C36 | H23 | 121.2° | 119.8° |
| O39 | C35 | C34 | 122.5° | 120.2° |
| C28 | N29 | C30 | 112.6° | 111.0° |
| N29 | C28 | H4 | 109.1° | 109.5° |
| N29 | C28 | H5 | 109.1° | 109.5° |
| C37 | C32 | C31 | 117.0° | 121.6° |
| C37 | C32 | C33 | 119.1° | 120.0° |
| C35 | C34 | C33 | 120.6° | 119.7° |
| C35 | C34 | O41 | 120.6° | 120.2° |
| N29 | C30 | C31 | 110.8° | 108.5° |
| N29 | C30 | H18 | 109.2° | 109.6° |
| N29 | C30 | H19 | 109.2° | 109.8° |
| C30 | C31 | C32 | 111.1° | 110.0° |
| C31 | C30 | H18 | 109.1° | 109.6° |
| C31 | C30 | H19 | 109.1° | 109.7° |
| C30 | C31 | H20 | 109.1° | 109.4° |
| C30 | C31 | H21 | 109.1° | 109.4° |
| C31 | C32 | C33 | 123.8° | 118.4° |
| C32 | C31 | H20 | 109.1° | 109.4° |
| C32 | C31 | H21 | 109.1° | 109.3° |
| C32 | C33 | C34 | 118.9° | 120.4° |
| C32 | C33 | H22 | 120.5° | 119.8° |
| C33 | C34 | O41 | 118.7° | 120.2° |
| C34 | C33 | H22 | 120.6° | 119.8° |
| C34 | O41 | C42 | 110.1° | 117.0° |
| O41 | C42 | H29 | 109.5° | 109.5° |
| O41 | C42 | H30 | 109.5° | 109.4° |
| O41 | C42 | H31 | 109.4° | 109.5° |
| H4 | C28 | H5 | 109.5° | 109.5° |
| H6 | C01 | H7 | 109.5° | 109.5° |
| H6 | C01 | H8 | 109.5° | 109.5° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.5° | 109.5° |
| H18 | C30 | H19 | 109.4° | 109.6° |
| H20 | C31 | H21 | 109.5° | 109.4° |
| H24 | C38 | H25 | 109.5° | 109.3° |
| H26 | C40 | H27 | 109.5° | 109.5° |
| H26 | C40 | H28 | 109.5° | 109.5° |
| H27 | C40 | H28 | 109.5° | 109.5° |
| H29 | C42 | H30 | 109.4° | 109.5° |
| H29 | C42 | H31 | 109.5° | 109.5° |
| H30 | C42 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C15 | C16 | H1 | 180.0° | 179.8° |
| C15 | C14 | C11 | H12 | 180.0° | 179.8° |
| C14 | C15 | C16 | C17 | 1.5° | 0.0° |
| C15 | C14 | C11 | C12 | 179.9° | 179.8° |
| C15 | C14 | C11 | C10 | 0.1° | 0.2° |
| C14 | C15 | C16 | H13 | 178.6° | 179.9° |
| C16 | C15 | C14 | C11 | 0.6° | 0.2° |
| C15 | C16 | C17 | H13 | 180.0° | 179.8° |
| C15 | C16 | C17 | C10 | 1.6° | 0.0° |
| C15 | C16 | C17 | C18 | 178.8° | 180.0° |
| C16 | C15 | C14 | H12 | 179.4° | 180.0° |
| C14 | C11 | C12 | O13 | 0.1° | 12.6° |
| C14 | C11 | C12 | C10 | 179.8° | 180.0° |
| C14 | C11 | C12 | C07 | 179.8° | 167.3° |
| C14 | C11 | C10 | C17 | 0.1° | 0.2° |
| C14 | C11 | C10 | N09 | 179.7° | 179.5° |
| C11 | C14 | C15 | H1 | 179.4° | 180.0° |
| O13 | C12 | C11 | C07 | 179.7° | 179.9° |
| O13 | C12 | C11 | C10 | 179.9° | 167.4° |
| O13 | C12 | C07 | C06 | 0.3° | 12.9° |
| O13 | C12 | C07 | C08 | 179.6° | 167.7° |
| C16 | C17 | C10 | C11 | 1.0° | 0.1° |
| C16 | C17 | C10 | C18 | 177.3° | 180.0° |
| C16 | C17 | C10 | N09 | 179.4° | 179.6° |
| C16 | C17 | C18 | N20 | 1.1° | 6.1° |
| C16 | C17 | C18 | O19 | 178.2° | 173.9° |
| C17 | C16 | C15 | H1 | 178.6° | 179.8° |
| C12 | C11 | C10 | C17 | 179.7° | 179.8° |
| C12 | C11 | C10 | N09 | 0.1° | 0.4° |
| C11 | C12 | C07 | C06 | 179.4° | 167.1° |
| C11 | C12 | C07 | C08 | 0.7° | 12.4° |
| C12 | C11 | C14 | H12 | 0.1° | 0.0° |
| C10 | C11 | C12 | C07 | 0.4° | 12.7° |
| C11 | C10 | C17 | N09 | 179.7° | 179.7° |
| C11 | C10 | C17 | C18 | 178.3° | 179.9° |
| C11 | C10 | N09 | C08 | 0.3° | 14.9° |
| C10 | C11 | C14 | H12 | 179.9° | 179.9° |
| C11 | C10 | N09 | H32 | 179.6° | 165.2° |
| C12 | C07 | C06 | C08 | 179.9° | 179.5° |
| C12 | C07 | C06 | C05 | 179.9° | 179.2° |
| C12 | C07 | C08 | N09 | 0.4° | 1.0° |
| C12 | C07 | C08 | C03 | 180.0° | 179.2° |
| C12 | C07 | C06 | H11 | 0.1° | 0.8° |
| C10 | C17 | C18 | N20 | 176.3° | 173.9° |
| C10 | C17 | C18 | O19 | 0.9° | 6.0° |
| C17 | C10 | N09 | C08 | 180.0° | 165.4° |
| C10 | C17 | C16 | H13 | 178.4° | 179.8° |
| C17 | C10 | N09 | H32 | 0.0° | 14.5° |
| C18 | C17 | C10 | N09 | 2.0° | 0.4° |
| C17 | C18 | N20 | O19 | 177.0° | 180.0° |
| C17 | C18 | N20 | C21 | 177.4° | 175.4° |
| C18 | C17 | C16 | H13 | 1.2° | 0.1° |
| C17 | C18 | N20 | H33 | 2.6° | 4.6° |
| C10 | N09 | C08 | C07 | 0.1° | 15.2° |
| C10 | N09 | C08 | H32 | 180.0° | 179.9° |
| C10 | N09 | C08 | C03 | 179.5° | 165.0° |
| C07 | C06 | C05 | H11 | 180.0° | 180.0° |
| C06 | C07 | C08 | N09 | 179.7° | 179.5° |
| C06 | C07 | C08 | C03 | 0.1° | 0.3° |
| C07 | C06 | C05 | C04 | 0.1° | 0.1° |
| C07 | C06 | C05 | H10 | 179.8° | 180.0° |
| C08 | C07 | C06 | C05 | 0.0° | 0.3° |
| C07 | C08 | N09 | C03 | 179.6° | 179.9° |
| C07 | C08 | C03 | C04 | 0.0° | 0.2° |
| C07 | C08 | C03 | O02 | 179.3° | 179.8° |
| C08 | C07 | C06 | H11 | 180.0° | 179.7° |
| C07 | C08 | N09 | H32 | 179.9° | 164.9° |
| C06 | C05 | C04 | H10 | 180.0° | 179.9° |
| C06 | C05 | C04 | C03 | 0.2° | 0.1° |
| C06 | C05 | C04 | H9 | 179.8° | 179.9° |
| C18 | N20 | C21 | H33 | 180.0° | 180.0° |
| C18 | N20 | C21 | C22 | 133.2° | 144.4° |
| C18 | N20 | C21 | C26 | 44.3° | 35.8° |
| C21 | N20 | C18 | O19 | 0.4° | 4.6° |
| N20 | C21 | C22 | C26 | 177.5° | 179.8° |
| N20 | C21 | C22 | C23 | 178.9° | 179.7° |
| N20 | C21 | C26 | C25 | 178.5° | 179.8° |
| N20 | C21 | C22 | H2 | 1.1° | 0.2° |
| N20 | C21 | C26 | H3 | 1.5° | 0.2° |
| O19 | C18 | N20 | H33 | 179.6° | 175.5° |
| N09 | C08 | C03 | C04 | 179.6° | 179.7° |
| N09 | C08 | C03 | O02 | 0.3° | 0.4° |
| C08 | C03 | C04 | C05 | 0.1° | 0.0° |
| C08 | C03 | C04 | O02 | 179.3° | 180.0° |
| C08 | C03 | O02 | C01 | 147.6° | 180.0° |
| C08 | C03 | C04 | H9 | 179.8° | 180.0° |
| C03 | C08 | N09 | H32 | 0.5° | 15.0° |
| C05 | C04 | C03 | H9 | 180.0° | 180.0° |
| C05 | C04 | C03 | O02 | 179.5° | 180.0° |
| C04 | C05 | C06 | H11 | 179.8° | 179.9° |
| C21 | C22 | C23 | H2 | 180.0° | 179.9° |
| C22 | C21 | C26 | C25 | 1.1° | 0.0° |
| C21 | C22 | C23 | C24 | 1.4° | 0.1° |
| C22 | C21 | C26 | H3 | 178.9° | 180.0° |
| C21 | C22 | C23 | H14 | 178.6° | 180.0° |
| C22 | C21 | N20 | H33 | 46.8° | 35.6° |
| C26 | C21 | C22 | C23 | 1.3° | 0.1° |
| C21 | C26 | C25 | H3 | 180.0° | 180.0° |
| C21 | C26 | C25 | C24 | 0.9° | 0.0° |
| C26 | C21 | C22 | H2 | 178.7° | 180.0° |
| C21 | C26 | C25 | H15 | 179.0° | 180.0° |
| C26 | C21 | N20 | H33 | 135.7° | 144.2° |
| C22 | C23 | C24 | H14 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 1.2° | 0.1° |
| C22 | C23 | C24 | C27 | 178.2° | 180.0° |
| C04 | C03 | O02 | C01 | 31.7° | 0.0° |
| C03 | C04 | C05 | H10 | 179.8° | 179.8° |
| C03 | O02 | C01 | H6 | 180.0° | 180.0° |
| C03 | O02 | C01 | H7 | 60.0° | 60.0° |
| C03 | O02 | C01 | H8 | 60.0° | 60.0° |
| O02 | C03 | C04 | H9 | 0.5° | 0.0° |
| C26 | C25 | C24 | C23 | 1.0° | 0.0° |
| C26 | C25 | C24 | H15 | 180.0° | 180.0° |
| C26 | C25 | C24 | C27 | 178.4° | 180.0° |
| C23 | C24 | C25 | C27 | 179.4° | 180.0° |
| C23 | C24 | C27 | C28 | 27.0° | 89.9° |
| C24 | C23 | C22 | H2 | 178.6° | 180.0° |
| C23 | C24 | C25 | H15 | 179.0° | 180.0° |
| C23 | C24 | C27 | H16 | 146.4° | 150.0° |
| C23 | C24 | C27 | H17 | 92.4° | 30.0° |
| O02 | C01 | H6 | H7 | 120.0° | 120.0° |
| O02 | C01 | H6 | H8 | 120.0° | 119.9° |
| O02 | C01 | H7 | H8 | 120.0° | 120.0° |
| C25 | C24 | C27 | C28 | 152.5° | 90.0° |
| C24 | C25 | C26 | H3 | 179.1° | 180.0° |
| C25 | C24 | C23 | H14 | 178.8° | 180.0° |
| C25 | C24 | C27 | H16 | 33.1° | 30.0° |
| C25 | C24 | C27 | H17 | 88.2° | 150.0° |
| C24 | C27 | C28 | H16 | 119.4° | 120.0° |
| C24 | C27 | C28 | H17 | 119.4° | 120.0° |
| C24 | C27 | C28 | N29 | 84.4° | 180.0° |
| C24 | C27 | C28 | H4 | 155.4° | 60.0° |
| C24 | C27 | C28 | H5 | 35.8° | 60.0° |
| C27 | C24 | C23 | H14 | 1.7° | 0.1° |
| C27 | C24 | C25 | H15 | 1.6° | 0.0° |
| C24 | C27 | H16 | H17 | 121.8° | 120.0° |
| C40 | O39 | C35 | C36 | 39.1° | 0.0° |
| C40 | O39 | C35 | C34 | 140.3° | 180.0° |
| O39 | C40 | H26 | H27 | 120.0° | 120.0° |
| O39 | C40 | H26 | H28 | 120.0° | 120.0° |
| O39 | C40 | H27 | H28 | 120.0° | 120.0° |
| C27 | C28 | N29 | C38 | 94.1° | 66.0° |
| C27 | C28 | N29 | H4 | 120.2° | 119.9° |
| C27 | C28 | N29 | H5 | 120.2° | 119.9° |
| C27 | C28 | N29 | C30 | 144.7° | 171.0° |
| C27 | C28 | H4 | H5 | 119.3° | 119.9° |
| C28 | C27 | H16 | H17 | 121.8° | 120.0° |
| C37 | C38 | N29 | H24 | 119.0° | 120.3° |
| C37 | C38 | N29 | H25 | 119.0° | 120.2° |
| C38 | C37 | C36 | C32 | 177.7° | 179.8° |
| C38 | C37 | C36 | C35 | 178.6° | 179.6° |
| C37 | C38 | N29 | C28 | 154.6° | 176.0° |
| C37 | C38 | N29 | C30 | 81.3° | 52.5° |
| C38 | C37 | C32 | C31 | 2.0° | 0.5° |
| C38 | C37 | C32 | C33 | 178.6° | 179.6° |
| C38 | C37 | C36 | H23 | 1.4° | 0.3° |
| C37 | C38 | H24 | H25 | 123.0° | 119.4° |
| N29 | C38 | C37 | C36 | 124.1° | 162.6° |
| C38 | N29 | C28 | C30 | 121.3° | 123.0° |
| N29 | C38 | C37 | C32 | 53.7° | 17.6° |
| C38 | N29 | C30 | C31 | 51.2° | 71.3° |
| C38 | N29 | C28 | H4 | 145.7° | 174.0° |
| C38 | N29 | C28 | H5 | 26.1° | 53.9° |
| C38 | N29 | C30 | H18 | 171.4° | 48.4° |
| C38 | N29 | C30 | H19 | 69.0° | 168.9° |
| N29 | C38 | H24 | H25 | 123.0° | 119.5° |
| C37 | C36 | C35 | H23 | 180.0° | 180.0° |
| C37 | C36 | C35 | O39 | 179.8° | 180.0° |
| C37 | C36 | C35 | C34 | 0.9° | 0.0° |
| C36 | C37 | C32 | C31 | 179.7° | 179.7° |
| C36 | C37 | C32 | C33 | 0.9° | 0.2° |
| C36 | C37 | C38 | H24 | 5.1° | 42.3° |
| C36 | C37 | C38 | H25 | 117.0° | 77.1° |
| C36 | C35 | O39 | C34 | 179.3° | 180.0° |
| C35 | C36 | C37 | C32 | 0.9° | 0.2° |
| C36 | C35 | C34 | C33 | 0.9° | 0.1° |
| C36 | C35 | C34 | O41 | 179.4° | 180.0° |
| O39 | C35 | C34 | C33 | 179.8° | 179.9° |
| O39 | C35 | C34 | O41 | 1.3° | 0.0° |
| O39 | C35 | C36 | H23 | 0.2° | 0.0° |
| C35 | O39 | C40 | H26 | 180.0° | 60.0° |
| C35 | O39 | C40 | H27 | 60.0° | 60.0° |
| C35 | O39 | C40 | H28 | 60.0° | 180.0° |
| C28 | N29 | C30 | C31 | 174.9° | 165.3° |
| N29 | C28 | H4 | H5 | 119.3° | 120.1° |
| N29 | C28 | C27 | H16 | 35.0° | 60.0° |
| N29 | C28 | C27 | H17 | 156.2° | 60.0° |
| C28 | N29 | C30 | H18 | 64.9° | 75.0° |
| C28 | N29 | C30 | H19 | 54.7° | 45.4° |
| C28 | N29 | C38 | H24 | 35.6° | 63.8° |
| C28 | N29 | C38 | H25 | 86.5° | 55.7° |
| C37 | C32 | C31 | C30 | 30.3° | 16.9° |
| C37 | C32 | C31 | C33 | 179.3° | 180.0° |
| C37 | C32 | C33 | C34 | 0.8° | 0.1° |
| C37 | C32 | C31 | H20 | 150.5° | 103.3° |
| C37 | C32 | C31 | H21 | 90.0° | 137.0° |
| C37 | C32 | C33 | H22 | 179.2° | 179.9° |
| C32 | C37 | C36 | H23 | 179.1° | 179.8° |
| C32 | C37 | C38 | H24 | 172.7° | 137.9° |
| C32 | C37 | C38 | H25 | 65.2° | 102.7° |
| C35 | C34 | C33 | C32 | 0.8° | 0.0° |
| C35 | C34 | C33 | O41 | 178.5° | 180.0° |
| C35 | C34 | O41 | C42 | 101.4° | 180.0° |
| C35 | C34 | C33 | H22 | 179.2° | 180.0° |
| C34 | C35 | C36 | H23 | 179.1° | 180.0° |
| N29 | C30 | C31 | H18 | 120.2° | 119.6° |
| N29 | C30 | C31 | H19 | 120.2° | 119.9° |
| N29 | C30 | C31 | C32 | 3.9° | 50.4° |
| C30 | N29 | C28 | H4 | 24.4° | 51.0° |
| C30 | N29 | C28 | H5 | 95.1° | 69.1° |
| N29 | C30 | H18 | H19 | 119.4° | 120.5° |
| N29 | C30 | C31 | H20 | 124.1° | 69.8° |
| N29 | C30 | C31 | H21 | 116.4° | 170.4° |
| C30 | N29 | C38 | H24 | 159.7° | 172.8° |
| C30 | N29 | C38 | H25 | 37.7° | 67.7° |
| C30 | C31 | C32 | H20 | 120.3° | 120.2° |
| C30 | C31 | C32 | H21 | 120.2° | 120.1° |
| C30 | C31 | C32 | C33 | 150.4° | 163.1° |
| C31 | C30 | H18 | H19 | 119.3° | 120.5° |
| C30 | C31 | H20 | H21 | 119.3° | 119.8° |
| C31 | C32 | C33 | C34 | 179.9° | 179.8° |
| C32 | C31 | C30 | H18 | 116.4° | 69.3° |
| C32 | C31 | C30 | H19 | 124.1° | 170.3° |
| C32 | C31 | H20 | H21 | 119.3° | 119.6° |
| C31 | C32 | C33 | H22 | 0.2° | 0.2° |
| C32 | C33 | C34 | H22 | 180.0° | 180.0° |
| C32 | C33 | C34 | O41 | 179.3° | 180.0° |
| C33 | C32 | C31 | H20 | 30.2° | 76.7° |
| C33 | C32 | C31 | H21 | 89.4° | 43.0° |
| C33 | C34 | O41 | C42 | 77.1° | 0.0° |
| O41 | C34 | C33 | H22 | 0.7° | 0.0° |
| C34 | O41 | C42 | H29 | 180.0° | 180.0° |
| C34 | O41 | C42 | H30 | 60.0° | 60.0° |
| C34 | O41 | C42 | H31 | 60.0° | 60.0° |
| O41 | C42 | H29 | H30 | 120.0° | 120.0° |
| O41 | C42 | H29 | H31 | 120.0° | 120.0° |
| O41 | C42 | H30 | H31 | 120.0° | 120.0° |
| H1 | C15 | C14 | H12 | 0.6° | 0.2° |
| H1 | C15 | C16 | H13 | 1.4° | 0.3° |
| H2 | C22 | C23 | H14 | 1.4° | 0.1° |
| H3 | C26 | C25 | H15 | 0.9° | 0.0° |
| H4 | C28 | C27 | H16 | 85.2° | 180.0° |
| H4 | C28 | C27 | H17 | 36.0° | 60.0° |
| H5 | C28 | C27 | H16 | 155.2° | 60.0° |
| H5 | C28 | C27 | H17 | 83.6° | 180.0° |
| H6 | C01 | H7 | H8 | 120.0° | 120.0° |
| H9 | C04 | C05 | H10 | 0.2° | 0.2° |
| H10 | C05 | C06 | H11 | 0.2° | 0.0° |
| H18 | C30 | C31 | H20 | 3.9° | 170.6° |
| H18 | C30 | C31 | H21 | 123.4° | 50.8° |
| H19 | C30 | C31 | H20 | 115.6° | 50.2° |
| H19 | C30 | C31 | H21 | 3.9° | 69.6° |
| H26 | C40 | H27 | H28 | 120.0° | 120.0° |
| H29 | C42 | H30 | H31 | 120.0° | 120.0° |
