E5K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C20 | doub | 1.38Å | 1.42Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.39Å | 1.41Å | Aromatic |
| C23 | C22 | sing | 1.48Å | 1.58Å | |
| O01 | C02 | doub | 1.21Å | 1.23Å | |
| C22 | C31 | doub | 1.39Å | 1.42Å | Aromatic |
| C19 | O18 | sing | 1.36Å | 1.42Å | |
| C19 | C32 | doub | 1.39Å | 1.41Å | Aromatic |
| O18 | C17 | sing | 1.43Å | 1.46Å | |
| C02 | C17 | sing | 1.51Å | 1.64Å | |
| C02 | N03 | sing | 1.35Å | 1.45Å | |
| C31 | C32 | sing | 1.38Å | 1.42Å | Aromatic |
| C06 | N03 | sing | 1.47Å | 1.47Å | |
| C06 | C07 | sing | 1.53Å | 1.55Å | |
| N03 | C04 | sing | 1.47Å | 1.52Å | |
| C07 | C08 | sing | 1.54Å | 1.52Å | |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| C08 | C05 | sing | 1.53Å | 1.53Å | |
| C08 | N09 | sing | 1.47Å | 1.52Å | |
| C16 | N09 | sing | 1.47Å | 1.49Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| N09 | C10 | sing | 1.47Å | 1.48Å | |
| C10 | C11 | sing | 1.53Å | 1.57Å | |
| C15 | N12 | sing | 1.47Å | 1.38Å | |
| N12 | C11 | sing | 1.47Å | 1.50Å | |
| N12 | C13 | sing | 1.47Å | 1.49Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | H5 | sing | 1.09Å | 1.10Å | |
| C06 | H6 | sing | 1.09Å | 1.10Å | |
| C07 | H7 | sing | 1.09Å | 1.10Å | |
| C07 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.08Å | 1.08Å | |
| C21 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | H32 | sing | 1.08Å | 1.08Å | |
| C32 | H33 | sing | 1.08Å | 1.08Å | |
| C23 | C1 | sing | 1.39Å | 48.12Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 0.00Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 0.00Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 0.00Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 0.00Å | Aromatic |
| C5 | C23 | doub | 1.39Å | 48.12Å | Aromatic |
| C3 | O1 | sing | 1.36Å | 0.00Å | |
| O1 | C7 | sing | 1.43Å | 0.00Å | |
| C1 | H10 | sing | 1.08Å | 0.00Å | |
| C2 | H15 | sing | 1.08Å | 0.00Å | |
| C4 | H29 | sing | 1.08Å | 0.00Å | |
| C5 | H30 | sing | 1.08Å | 0.00Å | |
| C7 | H31 | sing | 1.09Å | 0.00Å | |
| C7 | H34 | sing | 1.09Å | 0.00Å | |
| C7 | H35 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C21 | C22 | 125.6° | 120.0° |
| C21 | C20 | C19 | 122.5° | 120.0° |
| C21 | C20 | H27 | 118.7° | 119.9° |
| C20 | C21 | H28 | 117.2° | 120.0° |
| C21 | C22 | C23 | 123.7° | 120.1° |
| C21 | C22 | C31 | 110.4° | 119.9° |
| C22 | C21 | H28 | 117.2° | 120.0° |
| C20 | C19 | O18 | 122.2° | 119.9° |
| C20 | C19 | C32 | 113.5° | 120.1° |
| C19 | C20 | H27 | 118.7° | 120.0° |
| C23 | C22 | C31 | 126.0° | 120.1° |
| C22 | C23 | C1 | 15.7° | 120.1° |
| C22 | C23 | C5 | 15.7° | 120.1° |
| O01 | C02 | C17 | 116.9° | 120.0° |
| O01 | C02 | N03 | 116.7° | 120.0° |
| C22 | C31 | C32 | 125.3° | 120.0° |
| C22 | C31 | H32 | 117.3° | 120.0° |
| O18 | C19 | C32 | 124.3° | 119.9° |
| C19 | O18 | C17 | 120.3° | 117.0° |
| C19 | C32 | C31 | 122.7° | 120.0° |
| C19 | C32 | H33 | 118.6° | 119.9° |
| O18 | C17 | C02 | 117.5° | 109.5° |
| O18 | C17 | H25 | 107.4° | 109.5° |
| O18 | C17 | H26 | 107.4° | 109.4° |
| C17 | C02 | N03 | 126.4° | 120.0° |
| C02 | C17 | H25 | 107.4° | 109.5° |
| C02 | C17 | H26 | 107.4° | 109.5° |
| C02 | N03 | C06 | 125.1° | 120.6° |
| C02 | N03 | C04 | 124.4° | 120.6° |
| C32 | C31 | H32 | 117.3° | 120.0° |
| C31 | C32 | H33 | 118.7° | 120.0° |
| N03 | C06 | C07 | 115.6° | 108.8° |
| C06 | N03 | C04 | 110.5° | 118.7° |
| N03 | C06 | H5 | 107.9° | 109.6° |
| N03 | C06 | H6 | 107.9° | 109.6° |
| C06 | C07 | C08 | 111.6° | 109.2° |
| C07 | C06 | H5 | 107.9° | 109.6° |
| C07 | C06 | H6 | 107.9° | 109.6° |
| C06 | C07 | H7 | 108.9° | 109.5° |
| C06 | C07 | H8 | 109.0° | 109.5° |
| N03 | C04 | C05 | 115.7° | 108.8° |
| N03 | C04 | H1 | 107.9° | 109.6° |
| N03 | C04 | H2 | 107.9° | 109.6° |
| C07 | C08 | C05 | 109.0° | 109.7° |
| C07 | C08 | N09 | 113.2° | 109.4° |
| C08 | C07 | H7 | 109.0° | 109.6° |
| C08 | C07 | H8 | 108.9° | 109.4° |
| C07 | C08 | H9 | 110.0° | 109.4° |
| C04 | C05 | C08 | 112.3° | 109.3° |
| C05 | C04 | H1 | 107.9° | 109.6° |
| C05 | C04 | H2 | 107.9° | 109.6° |
| C04 | C05 | H3 | 108.8° | 109.5° |
| C04 | C05 | H4 | 108.8° | 109.5° |
| C05 | C08 | N09 | 104.5° | 109.6° |
| C08 | C05 | H3 | 108.8° | 109.5° |
| C08 | C05 | H4 | 108.8° | 109.6° |
| C05 | C08 | H9 | 109.9° | 109.2° |
| C08 | N09 | C16 | 107.0° | 111.0° |
| C08 | N09 | C10 | 111.2° | 111.0° |
| N09 | C08 | H9 | 110.0° | 109.5° |
| N09 | C16 | C15 | 110.1° | 109.3° |
| C16 | N09 | C10 | 110.0° | 110.9° |
| N09 | C16 | H23 | 109.3° | 109.4° |
| N09 | C16 | H24 | 109.3° | 109.5° |
| C16 | C15 | N12 | 113.4° | 109.3° |
| C16 | C15 | H21 | 108.5° | 109.4° |
| C16 | C15 | H22 | 108.5° | 109.6° |
| C15 | C16 | H23 | 109.3° | 109.5° |
| C15 | C16 | H24 | 109.3° | 109.5° |
| N09 | C10 | C11 | 109.5° | 109.3° |
| N09 | C10 | H11 | 109.5° | 109.5° |
| N09 | C10 | H12 | 109.5° | 109.5° |
| C10 | C11 | N12 | 113.6° | 109.4° |
| C11 | C10 | H11 | 109.5° | 109.5° |
| C11 | C10 | H12 | 109.4° | 109.5° |
| C10 | C11 | H13 | 108.4° | 109.5° |
| C10 | C11 | H14 | 108.4° | 109.5° |
| C15 | N12 | C11 | 111.5° | 110.9° |
| C15 | N12 | C13 | 107.6° | 111.0° |
| N12 | C15 | H21 | 108.5° | 109.5° |
| N12 | C15 | H22 | 108.5° | 109.5° |
| C11 | N12 | C13 | 107.7° | 111.0° |
| N12 | C11 | H13 | 108.4° | 109.5° |
| N12 | C11 | H14 | 108.4° | 109.5° |
| N12 | C13 | C14 | 107.1° | 109.5° |
| N12 | C13 | H16 | 110.1° | 109.4° |
| N12 | C13 | H17 | 110.1° | 109.5° |
| C14 | C13 | H16 | 110.1° | 109.5° |
| C14 | C13 | H17 | 110.0° | 109.5° |
| C13 | C14 | H18 | 109.5° | 109.4° |
| C13 | C14 | H19 | 109.5° | 109.5° |
| C13 | C14 | H20 | 109.4° | 109.5° |
| H1 | C04 | H2 | 109.5° | 109.7° |
| H3 | C05 | H4 | 109.5° | 109.5° |
| H5 | C06 | H6 | 109.5° | 109.7° |
| H7 | C07 | H8 | 109.5° | 109.5° |
| H11 | C10 | H12 | 109.5° | 109.6° |
| H13 | C11 | H14 | 109.5° | 109.5° |
| H16 | C13 | H17 | 109.5° | 109.5° |
| H18 | C14 | H19 | 109.4° | 109.5° |
| H18 | C14 | H20 | 109.5° | 109.5° |
| H19 | C14 | H20 | 109.5° | 109.5° |
| H21 | C15 | H22 | 109.5° | 109.5° |
| H23 | C16 | H24 | 109.5° | 109.5° |
| H25 | C17 | H26 | 109.5° | 109.5° |
| C23 | C1 | C2 | 90.0° | 119.9° |
| C1 | C23 | C5 | 0.0° | 119.9° |
| C23 | C1 | H10 | 90.0° | 120.0° |
| C1 | C2 | C3 | 90.0° | 120.0° |
| C2 | C1 | H10 | 90.0° | 120.0° |
| C1 | C2 | H15 | 90.0° | 120.0° |
| C2 | C3 | C4 | 90.0° | 120.2° |
| C2 | C3 | O1 | 90.0° | 119.9° |
| C3 | C2 | H15 | 90.0° | 120.0° |
| C3 | C4 | C5 | 90.0° | 120.1° |
| C4 | C3 | O1 | 90.0° | 119.9° |
| C3 | C4 | H29 | 90.0° | 120.0° |
| C4 | C5 | C23 | 90.0° | 119.9° |
| C5 | C4 | H29 | 90.0° | 120.0° |
| C4 | C5 | H30 | 90.0° | 120.1° |
| C23 | C5 | H30 | 90.0° | 120.0° |
| C3 | O1 | C7 | 90.0° | 117.0° |
| O1 | C7 | H31 | 90.0° | 109.4° |
| O1 | C7 | H34 | 90.0° | 109.5° |
| O1 | C7 | H35 | 90.0° | 109.4° |
| H31 | C7 | H34 | 90.0° | 109.6° |
| H31 | C7 | H35 | 90.0° | 109.5° |
| H34 | C7 | H35 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C21 | C22 | H28 | 180.0° | 179.9° |
| C21 | C20 | C19 | H27 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 180.0° | 179.9° |
| C20 | C21 | C22 | C31 | 0.1° | 0.1° |
| C21 | C20 | C19 | O18 | 179.8° | 179.9° |
| C21 | C20 | C19 | C32 | 0.1° | 0.3° |
| C22 | C21 | C20 | C19 | 0.1° | 0.0° |
| C21 | C22 | C23 | C31 | 179.9° | 179.9° |
| C21 | C22 | C31 | C32 | 0.1° | 0.2° |
| C22 | C21 | C20 | H27 | 179.9° | 179.9° |
| C21 | C22 | C31 | H32 | 179.9° | 180.0° |
| C21 | C22 | C23 | C1 | 31.7° | 180.0° |
| C21 | C22 | C23 | C5 | 31.7° | 0.4° |
| C20 | C19 | O18 | C32 | 179.6° | 179.7° |
| C20 | C19 | O18 | C17 | 147.9° | 0.3° |
| C20 | C19 | C32 | C31 | 0.2° | 0.6° |
| C19 | C20 | C21 | H28 | 179.9° | 179.9° |
| C20 | C19 | C32 | H33 | 179.8° | 179.7° |
| C23 | C22 | C31 | C32 | 180.0° | 179.7° |
| C23 | C22 | C21 | H28 | 0.0° | 0.2° |
| C23 | C22 | C31 | H32 | 0.0° | 0.1° |
| C22 | C23 | C1 | C5 | 90.0° | 179.7° |
| C22 | C23 | C1 | C2 | 90.0° | 179.9° |
| C22 | C23 | C5 | C4 | 90.0° | 179.7° |
| C22 | C23 | C1 | H10 | 90.0° | 0.1° |
| C22 | C23 | C5 | H30 | 90.0° | 0.3° |
| O01 | C02 | C17 | O18 | 2.7° | 0.1° |
| O01 | C02 | C17 | N03 | 179.8° | 179.8° |
| O01 | C02 | N03 | C06 | 0.9° | 179.7° |
| O01 | C02 | N03 | C04 | 179.5° | 0.0° |
| O01 | C02 | C17 | H25 | 118.4° | 120.0° |
| O01 | C02 | C17 | H26 | 123.9° | 120.0° |
| C22 | C31 | C32 | C19 | 0.2° | 0.5° |
| C22 | C31 | C32 | H32 | 180.0° | 179.8° |
| C31 | C22 | C21 | H28 | 179.9° | 180.0° |
| C22 | C31 | C32 | H33 | 179.8° | 179.8° |
| C31 | C22 | C23 | C1 | 148.1° | 0.1° |
| C31 | C22 | C23 | C5 | 148.1° | 179.8° |
| C19 | O18 | C17 | C02 | 159.7° | 180.0° |
| O18 | C19 | C32 | C31 | 179.8° | 179.8° |
| C19 | O18 | C17 | H25 | 79.1° | 59.9° |
| C19 | O18 | C17 | H26 | 38.6° | 60.0° |
| O18 | C19 | C20 | H27 | 0.2° | 0.1° |
| O18 | C19 | C32 | H33 | 0.2° | 0.1° |
| C32 | C19 | O18 | C17 | 32.5° | 180.0° |
| C19 | C32 | C31 | H33 | 180.0° | 179.7° |
| C32 | C19 | C20 | H27 | 179.9° | 179.8° |
| C19 | C32 | C31 | H32 | 179.8° | 179.7° |
| O18 | C17 | C02 | H25 | 121.2° | 120.0° |
| O18 | C17 | C02 | H26 | 121.2° | 119.9° |
| O18 | C17 | C02 | N03 | 177.5° | 179.7° |
| O18 | C17 | H25 | H26 | 116.4° | 119.9° |
| C17 | C02 | N03 | C06 | 179.3° | 0.0° |
| C17 | C02 | N03 | C04 | 0.7° | 179.8° |
| C02 | C17 | H25 | H26 | 116.4° | 120.1° |
| C02 | N03 | C06 | C04 | 178.8° | 179.7° |
| C02 | N03 | C06 | C07 | 132.6° | 126.4° |
| C02 | N03 | C04 | C05 | 135.1° | 126.4° |
| C02 | N03 | C04 | H1 | 14.1° | 6.6° |
| C02 | N03 | C04 | H2 | 104.1° | 113.8° |
| C02 | N03 | C06 | H5 | 106.5° | 113.8° |
| C02 | N03 | C06 | H6 | 11.7° | 6.6° |
| N03 | C02 | C17 | H25 | 61.3° | 60.3° |
| N03 | C02 | C17 | H26 | 56.4° | 59.8° |
| N03 | C06 | C07 | H5 | 120.9° | 119.8° |
| N03 | C06 | C07 | H6 | 120.9° | 119.8° |
| N03 | C06 | C07 | C08 | 55.7° | 54.5° |
| C06 | N03 | C04 | C05 | 46.1° | 53.9° |
| C06 | N03 | C04 | H1 | 167.0° | 173.6° |
| C06 | N03 | C04 | H2 | 74.7° | 65.9° |
| N03 | C06 | H5 | H6 | 117.2° | 120.3° |
| N03 | C06 | C07 | H7 | 176.0° | 174.6° |
| N03 | C06 | C07 | H8 | 64.6° | 65.3° |
| C07 | C06 | N03 | C04 | 48.6° | 53.9° |
| C06 | C07 | C08 | H7 | 120.3° | 120.0° |
| C06 | C07 | C08 | H8 | 120.3° | 119.9° |
| C06 | C07 | C08 | C05 | 55.6° | 61.1° |
| C06 | C07 | C08 | N09 | 171.5° | 178.6° |
| C07 | C06 | H5 | H6 | 117.3° | 120.3° |
| C06 | C07 | H7 | H8 | 119.0° | 120.1° |
| C06 | C07 | C08 | H9 | 64.9° | 58.7° |
| N03 | C04 | C05 | H1 | 120.9° | 119.8° |
| N03 | C04 | C05 | H2 | 120.9° | 119.8° |
| N03 | C04 | C05 | C08 | 50.4° | 54.6° |
| N03 | C04 | H1 | H2 | 117.2° | 120.4° |
| N03 | C04 | C05 | H3 | 70.1° | 65.3° |
| N03 | C04 | C05 | H4 | 170.8° | 174.7° |
| C04 | N03 | C06 | H5 | 72.3° | 66.0° |
| C04 | N03 | C06 | H6 | 169.5° | 173.7° |
| C07 | C08 | C05 | C04 | 53.6° | 61.1° |
| C07 | C08 | C05 | N09 | 121.3° | 120.2° |
| C07 | C08 | C05 | H9 | 120.6° | 119.8° |
| C07 | C08 | N09 | H9 | 123.5° | 119.9° |
| C07 | C08 | N09 | C16 | 61.9° | 66.3° |
| C07 | C08 | N09 | C10 | 58.2° | 170.0° |
| C07 | C08 | C05 | H3 | 66.8° | 58.8° |
| C07 | C08 | C05 | H4 | 174.0° | 178.9° |
| C08 | C07 | C06 | H5 | 65.2° | 65.3° |
| C08 | C07 | C06 | H6 | 176.6° | 174.3° |
| C08 | C07 | H7 | H8 | 119.0° | 120.0° |
| C04 | C05 | C08 | H3 | 120.4° | 119.9° |
| C04 | C05 | C08 | H4 | 120.4° | 120.0° |
| C04 | C05 | C08 | N09 | 174.9° | 178.7° |
| C05 | C04 | H1 | H2 | 117.1° | 120.4° |
| C04 | C05 | H3 | H4 | 118.7° | 120.1° |
| C04 | C05 | C08 | H9 | 67.1° | 58.8° |
| C05 | C08 | N09 | H9 | 118.0° | 119.7° |
| C05 | C08 | N09 | C16 | 179.6° | 54.1° |
| C05 | C08 | N09 | C10 | 60.3° | 69.7° |
| C08 | C05 | C04 | H1 | 171.3° | 174.4° |
| C08 | C05 | C04 | H2 | 70.5° | 65.2° |
| C08 | C05 | H3 | H4 | 118.7° | 120.1° |
| C05 | C08 | C07 | H7 | 175.9° | 178.9° |
| C05 | C08 | C07 | H8 | 64.7° | 58.8° |
| C08 | N09 | C16 | C10 | 120.9° | 123.8° |
| C08 | N09 | C16 | C15 | 180.0° | 176.8° |
| C08 | N09 | C10 | C11 | 173.0° | 176.8° |
| N09 | C08 | C05 | H3 | 54.5° | 61.4° |
| N09 | C08 | C05 | H4 | 64.7° | 58.7° |
| N09 | C08 | C07 | H7 | 68.2° | 58.6° |
| N09 | C08 | C07 | H8 | 51.2° | 61.5° |
| C08 | N09 | C10 | H11 | 53.0° | 63.2° |
| C08 | N09 | C10 | H12 | 67.0° | 56.8° |
| C08 | N09 | C16 | H23 | 59.9° | 56.9° |
| C08 | N09 | C16 | H24 | 59.9° | 63.2° |
| N09 | C16 | C15 | H23 | 120.1° | 119.9° |
| N09 | C16 | C15 | H24 | 120.1° | 120.0° |
| C16 | N09 | C10 | C11 | 54.7° | 59.3° |
| N09 | C16 | C15 | N12 | 60.1° | 58.5° |
| C16 | N09 | C08 | H9 | 61.7° | 173.9° |
| C16 | N09 | C10 | H11 | 65.3° | 60.6° |
| C16 | N09 | C10 | H12 | 174.7° | 179.3° |
| N09 | C16 | C15 | H21 | 60.5° | 178.4° |
| N09 | C16 | C15 | H22 | 179.3° | 61.5° |
| N09 | C16 | H23 | H24 | 119.7° | 120.1° |
| C15 | C16 | N09 | C10 | 59.1° | 59.4° |
| C16 | C15 | N12 | H21 | 120.6° | 119.9° |
| C16 | C15 | N12 | H22 | 120.6° | 120.0° |
| C16 | C15 | N12 | C11 | 54.5° | 59.4° |
| C16 | C15 | N12 | C13 | 172.5° | 176.8° |
| C16 | C15 | H21 | H22 | 118.2° | 120.1° |
| C15 | C16 | H23 | H24 | 119.7° | 120.1° |
| N09 | C10 | C11 | H11 | 120.0° | 119.9° |
| N09 | C10 | C11 | H12 | 120.0° | 119.9° |
| N09 | C10 | C11 | N12 | 50.5° | 58.4° |
| C10 | N09 | C08 | H9 | 178.3° | 50.1° |
| N09 | C10 | H11 | H12 | 120.0° | 120.0° |
| N09 | C10 | C11 | H13 | 171.1° | 178.4° |
| N09 | C10 | C11 | H14 | 70.2° | 61.6° |
| C10 | N09 | C16 | H23 | 179.2° | 179.3° |
| C10 | N09 | C16 | H24 | 61.0° | 60.7° |
| C10 | C11 | N12 | C15 | 50.4° | 59.4° |
| C10 | C11 | N12 | H13 | 120.6° | 120.0° |
| C10 | C11 | N12 | H14 | 120.6° | 120.0° |
| C10 | C11 | N12 | C13 | 168.3° | 176.8° |
| C11 | C10 | H11 | H12 | 120.0° | 120.1° |
| C10 | C11 | H13 | H14 | 118.1° | 120.0° |
| C15 | N12 | C11 | C13 | 117.9° | 123.8° |
| C15 | N12 | C13 | C14 | 163.5° | 66.3° |
| C15 | N12 | C11 | H13 | 171.0° | 179.3° |
| C15 | N12 | C11 | H14 | 70.2° | 60.6° |
| C15 | N12 | C13 | H16 | 76.8° | 173.8° |
| C15 | N12 | C13 | H17 | 43.9° | 53.8° |
| N12 | C15 | H21 | H22 | 118.2° | 120.1° |
| N12 | C15 | C16 | H23 | 179.8° | 178.4° |
| N12 | C15 | C16 | H24 | 60.0° | 61.6° |
| C11 | N12 | C13 | C14 | 76.1° | 170.0° |
| N12 | C11 | C10 | H11 | 69.5° | 61.5° |
| N12 | C11 | C10 | H12 | 170.5° | 178.3° |
| N12 | C11 | H13 | H14 | 118.1° | 120.1° |
| C11 | N12 | C13 | H16 | 43.5° | 50.0° |
| C11 | N12 | C13 | H17 | 164.3° | 70.0° |
| C11 | N12 | C15 | H21 | 66.1° | 179.3° |
| C11 | N12 | C15 | H22 | 175.1° | 60.7° |
| N12 | C13 | C14 | H16 | 119.6° | 119.9° |
| N12 | C13 | C14 | H17 | 119.6° | 120.1° |
| C13 | N12 | C11 | H13 | 71.1° | 56.9° |
| C13 | N12 | C11 | H14 | 47.7° | 63.2° |
| N12 | C13 | H16 | H17 | 121.1° | 120.0° |
| N12 | C13 | C14 | H18 | 180.0° | 60.0° |
| N12 | C13 | C14 | H19 | 60.0° | 59.9° |
| N12 | C13 | C14 | H20 | 60.0° | 180.0° |
| C13 | N12 | C15 | H21 | 51.9° | 56.9° |
| C13 | N12 | C15 | H22 | 66.9° | 63.2° |
| C14 | C13 | H16 | H17 | 121.1° | 120.0° |
| C13 | C14 | H18 | H19 | 120.0° | 120.0° |
| C13 | C14 | H18 | H20 | 120.0° | 120.0° |
| C13 | C14 | H19 | H20 | 120.0° | 120.0° |
| H1 | C04 | C05 | H3 | 50.8° | 54.5° |
| H1 | C04 | C05 | H4 | 68.3° | 65.6° |
| H2 | C04 | C05 | H3 | 169.0° | 174.9° |
| H2 | C04 | C05 | H4 | 49.9° | 54.9° |
| H3 | C05 | C08 | H9 | 172.5° | 178.7° |
| H4 | C05 | C08 | H9 | 53.4° | 61.3° |
| H5 | C06 | C07 | H7 | 55.1° | 54.8° |
| H5 | C06 | C07 | H8 | 174.5° | 174.9° |
| H6 | C06 | C07 | H7 | 63.1° | 65.6° |
| H6 | C06 | C07 | H8 | 56.3° | 54.5° |
| H7 | C07 | C08 | H9 | 55.3° | 61.4° |
| H8 | C07 | C08 | H9 | 174.7° | 178.5° |
| H11 | C10 | C11 | H13 | 51.1° | 58.5° |
| H11 | C10 | C11 | H14 | 169.8° | 178.5° |
| H12 | C10 | C11 | H13 | 68.9° | 61.7° |
| H12 | C10 | C11 | H14 | 49.8° | 58.3° |
| H16 | C13 | C14 | H18 | 60.4° | 180.0° |
| H16 | C13 | C14 | H19 | 179.6° | 60.0° |
| H16 | C13 | C14 | H20 | 59.6° | 60.0° |
| H17 | C13 | C14 | H18 | 60.4° | 60.0° |
| H17 | C13 | C14 | H19 | 59.6° | NaN° |
| H17 | C13 | C14 | H20 | 179.6° | 60.0° |
| H18 | C14 | H19 | H20 | 120.0° | 120.1° |
| H21 | C15 | C16 | H23 | 59.6° | 61.7° |
| H21 | C15 | C16 | H24 | 179.5° | 58.4° |
| H22 | C15 | C16 | H23 | 59.2° | 58.4° |
| H22 | C15 | C16 | H24 | 60.6° | 178.4° |
| H27 | C20 | C21 | H28 | 0.1° | 0.0° |
| H32 | C31 | C32 | H33 | 0.2° | 0.0° |
| C23 | C1 | C2 | H10 | 90.0° | 180.0° |
| C23 | C1 | C2 | C3 | 90.0° | 0.0° |
| C1 | C23 | C5 | C4 | 90.0° | 0.6° |
| C23 | C1 | C2 | H15 | 90.0° | 179.9° |
| C1 | C23 | C5 | H30 | 90.0° | 180.0° |
| C1 | C2 | C3 | H15 | 90.0° | 179.9° |
| C1 | C2 | C3 | C4 | 90.0° | 0.0° |
| C2 | C1 | C23 | C5 | 90.0° | 0.3° |
| C1 | C2 | C3 | O1 | 90.0° | 180.0° |
| C2 | C3 | C4 | O1 | 90.0° | 180.0° |
| C2 | C3 | C4 | C5 | 90.0° | 0.3° |
| C2 | C3 | O1 | C7 | 90.0° | 180.0° |
| C3 | C2 | C1 | H10 | 90.0° | 179.9° |
| C2 | C3 | C4 | H29 | 90.0° | 180.0° |
| C3 | C4 | C5 | H29 | 90.0° | 179.8° |
| C3 | C4 | C5 | C23 | 90.0° | 0.6° |
| C4 | C3 | O1 | C7 | 90.0° | 0.0° |
| C4 | C3 | C2 | H15 | 90.0° | 179.9° |
| C3 | C4 | C5 | H30 | 90.0° | 180.0° |
| C4 | C5 | C23 | H30 | 90.0° | 179.4° |
| C5 | C4 | C3 | O1 | 90.0° | 179.7° |
| C5 | C23 | C1 | H10 | 90.0° | 179.7° |
| C23 | C5 | C4 | H29 | 90.0° | 179.6° |
| O1 | C3 | C2 | H15 | 90.0° | 0.1° |
| O1 | C3 | C4 | H29 | 90.0° | 0.1° |
| C3 | O1 | C7 | H31 | 90.0° | 60.0° |
| C3 | O1 | C7 | H34 | 90.0° | 60.0° |
| C3 | O1 | C7 | H35 | 90.0° | 180.0° |
| O1 | C7 | H31 | H34 | 90.0° | 120.0° |
| O1 | C7 | H31 | H35 | 90.0° | 119.9° |
| O1 | C7 | H34 | H35 | 90.0° | 120.0° |
| H10 | C1 | C2 | H15 | 90.0° | 0.0° |
| H29 | C4 | C5 | H30 | 90.0° | 0.2° |
| H31 | C7 | H34 | H35 | 90.0° | 120.0° |
