A1ETE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C09 | sing | 1.53Å | 1.50Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C13 | C08 | sing | 1.53Å | 1.56Å | |
| C13 | C12 | sing | 1.53Å | 1.56Å | |
| C15 | C14 | sing | 1.51Å | 1.21Å | |
| C15 | C16 | doub | 1.37Å | 1.56Å | Aromatic |
| C15 | C31 | sing | 1.40Å | 1.48Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.20Å | Aromatic |
| C17 | O18 | sing | 1.36Å | 1.41Å | |
| C17 | C27 | doub | 1.39Å | 1.03Å | Aromatic |
| C20 | C21 | sing | 1.53Å | 1.57Å | |
| C20 | C19 | sing | 1.53Å | 1.57Å | |
| C21 | C22 | sing | 1.51Å | 1.55Å | |
| C22 | N23 | sing | 1.35Å | 1.37Å | Aromatic |
| C22 | N26 | doub | 1.31Å | 1.28Å | Aromatic |
| O01 | C02 | doub | 1.21Å | 1.18Å | |
| C03 | C04 | sing | 1.53Å | 1.59Å | |
| C03 | C08 | sing | 1.53Å | 1.45Å | |
| C03 | C14 | sing | 1.53Å | 1.38Å | |
| C04 | C05 | sing | 1.53Å | 1.56Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| C06 | C07 | sing | 1.53Å | 1.54Å | |
| C08 | C09 | sing | 1.53Å | 1.56Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| O18 | C19 | sing | 1.43Å | 1.40Å | |
| N23 | N24 | sing | 1.29Å | 1.43Å | Aromatic |
| N24 | N25 | doub | 1.29Å | 1.37Å | Aromatic |
| N25 | N26 | sing | 1.29Å | 1.28Å | Aromatic |
| C27 | C29 | sing | 1.38Å | 1.17Å | Aromatic |
| C27 | F28 | sing | 1.35Å | 1.35Å | |
| C29 | C31 | doub | 1.41Å | 1.48Å | Aromatic |
| C29 | F30 | sing | 1.35Å | 1.36Å | |
| C31 | C02 | sing | 1.47Å | 1.74Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C05 | H13 | sing | 1.09Å | 1.10Å | |
| C05 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C06 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C07 | H18 | sing | 1.09Å | 1.10Å | |
| C07 | H19 | sing | 1.09Å | 1.10Å | |
| C08 | H20 | sing | 1.09Å | 1.10Å | |
| C09 | H21 | sing | 1.09Å | 1.10Å | |
| C09 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C12 | H25 | sing | 1.09Å | 1.10Å | |
| C12 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C14 | H28 | sing | 1.09Å | 1.10Å | |
| C16 | H29 | sing | 1.08Å | 1.08Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| N23 | H32 | sing | 0.97Å | 1.00Å | |
| C02 | C03 | sing | 1.51Å | 1.76Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C09 | C10 | C11 | 107.9° | 109.5° |
| C10 | C09 | C08 | 111.1° | 109.5° |
| C09 | C10 | H1 | 109.9° | 109.5° |
| C09 | C10 | H2 | 109.9° | 109.5° |
| C10 | C09 | H21 | 109.1° | 109.4° |
| C10 | C09 | H22 | 109.0° | 109.4° |
| C10 | C11 | C12 | 111.4° | 109.5° |
| C11 | C10 | H1 | 109.8° | 109.5° |
| C11 | C10 | H2 | 109.9° | 109.4° |
| C10 | C11 | H23 | 109.0° | 109.4° |
| C10 | C11 | H24 | 109.0° | 109.5° |
| C08 | C13 | C12 | 110.1° | 109.5° |
| C13 | C08 | C03 | 108.5° | 109.5° |
| C13 | C08 | C09 | 108.5° | 109.4° |
| C08 | C13 | H3 | 109.3° | 109.5° |
| C08 | C13 | H4 | 109.3° | 109.5° |
| C13 | C08 | H20 | 109.0° | 109.5° |
| C13 | C12 | C11 | 112.3° | 109.5° |
| C12 | C13 | H3 | 109.3° | 109.4° |
| C12 | C13 | H4 | 109.3° | 109.5° |
| C13 | C12 | H25 | 108.8° | 109.5° |
| C13 | C12 | H26 | 108.8° | 109.4° |
| C14 | C15 | C16 | 133.3° | 130.4° |
| C14 | C15 | C31 | 121.3° | 109.5° |
| C15 | C14 | C03 | 120.6° | 106.2° |
| C15 | C14 | H27 | 106.6° | 110.1° |
| C15 | C14 | H28 | 106.6° | 110.1° |
| C16 | C15 | C31 | 105.5° | 120.1° |
| C15 | C16 | C17 | 124.5° | 120.6° |
| C15 | C16 | H29 | 117.7° | 119.7° |
| C15 | C31 | C29 | 111.4° | 119.4° |
| C15 | C31 | C02 | 95.8° | 110.6° |
| C16 | C17 | O18 | 118.2° | 120.0° |
| C16 | C17 | C27 | 126.8° | 120.1° |
| C17 | C16 | H29 | 117.7° | 119.7° |
| O18 | C17 | C27 | 115.0° | 119.9° |
| C17 | O18 | C19 | 112.6° | 117.0° |
| C17 | C27 | C29 | 125.9° | 119.9° |
| C17 | C27 | F28 | 115.5° | 120.0° |
| C21 | C20 | C19 | 109.7° | 109.5° |
| C20 | C21 | C22 | 108.8° | 109.5° |
| C21 | C20 | H5 | 109.4° | 109.4° |
| C21 | C20 | H6 | 109.4° | 109.5° |
| C20 | C21 | H7 | 109.6° | 109.5° |
| C20 | C21 | H8 | 109.6° | 109.5° |
| C20 | C19 | O18 | 110.5° | 109.4° |
| C19 | C20 | H5 | 109.4° | 109.5° |
| C19 | C20 | H6 | 109.4° | 109.5° |
| C20 | C19 | H30 | 109.2° | 109.4° |
| C20 | C19 | H31 | 109.2° | 109.5° |
| C21 | C22 | N23 | 126.8° | 126.7° |
| C21 | C22 | N26 | 127.1° | 126.7° |
| C22 | C21 | H7 | 109.7° | 109.5° |
| C22 | C21 | H8 | 109.6° | 109.4° |
| N23 | C22 | N26 | 106.1° | 106.6° |
| C22 | N23 | N24 | 105.9° | 107.2° |
| C22 | N23 | H32 | 127.1° | 126.4° |
| C22 | N26 | N25 | 116.2° | 108.0° |
| O01 | C02 | C31 | 129.2° | 125.8° |
| O01 | C02 | C03 | 129.8° | 125.9° |
| C04 | C03 | C08 | 107.6° | 110.2° |
| C04 | C03 | C14 | 112.7° | 110.3° |
| C03 | C04 | C05 | 115.5° | 109.5° |
| C03 | C04 | H11 | 107.9° | 109.4° |
| C03 | C04 | H12 | 107.9° | 109.4° |
| C04 | C03 | C02 | 114.9° | 110.2° |
| C08 | C03 | C14 | 112.5° | 110.4° |
| C03 | C08 | C09 | 111.6° | 109.5° |
| C03 | C08 | H20 | 110.4° | 109.5° |
| C08 | C03 | C02 | 111.2° | 110.3° |
| C03 | C14 | H27 | 106.6° | 110.1° |
| C03 | C14 | H28 | 106.6° | 110.1° |
| C14 | C03 | C02 | 97.9° | 105.4° |
| C04 | C05 | C06 | 109.7° | 109.4° |
| C05 | C04 | H11 | 107.9° | 109.6° |
| C05 | C04 | H12 | 107.9° | 109.5° |
| C04 | C05 | H13 | 109.4° | 109.5° |
| C04 | C05 | H14 | 109.4° | 109.5° |
| C05 | C06 | C07 | 109.8° | 109.5° |
| C06 | C05 | H13 | 109.4° | 109.5° |
| C06 | C05 | H14 | 109.4° | 109.4° |
| C05 | C06 | H15 | 109.4° | 109.5° |
| C05 | C06 | H16 | 109.4° | 109.5° |
| C07 | C06 | H15 | 109.4° | 109.5° |
| C07 | C06 | H16 | 109.4° | 109.5° |
| C06 | C07 | H17 | 109.5° | 109.5° |
| C06 | C07 | H18 | 109.5° | 109.5° |
| C06 | C07 | H19 | 109.5° | 109.5° |
| C09 | C08 | H20 | 108.9° | 109.5° |
| C08 | C09 | H21 | 109.1° | 109.5° |
| C08 | C09 | H22 | 109.1° | 109.5° |
| C12 | C11 | H23 | 109.0° | 109.5° |
| C12 | C11 | H24 | 109.0° | 109.5° |
| C11 | C12 | H25 | 108.8° | 109.5° |
| C11 | C12 | H26 | 108.8° | 109.5° |
| O18 | C19 | H30 | 109.2° | 109.5° |
| O18 | C19 | H31 | 109.2° | 109.5° |
| N23 | N24 | N25 | 105.7° | 108.8° |
| N24 | N23 | H32 | 127.0° | 126.5° |
| N24 | N25 | N26 | 106.2° | 109.4° |
| C29 | C27 | F28 | 118.6° | 120.1° |
| C27 | C29 | C31 | 125.9° | 119.9° |
| C27 | C29 | F30 | 117.9° | 120.0° |
| C31 | C29 | F30 | 116.2° | 120.0° |
| C29 | C31 | C02 | 152.8° | 129.9° |
| C31 | C02 | C03 | 101.0° | 108.2° |
| H1 | C10 | H2 | 109.5° | 109.4° |
| H3 | C13 | H4 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.5° |
| H7 | C21 | H8 | 109.5° | 109.5° |
| H11 | C04 | H12 | 109.5° | 109.5° |
| H13 | C05 | H14 | 109.5° | 109.5° |
| H15 | C06 | H16 | 109.5° | 109.4° |
| H17 | C07 | H18 | 109.5° | 109.4° |
| H17 | C07 | H19 | 109.4° | 109.5° |
| H18 | C07 | H19 | 109.5° | 109.5° |
| H21 | C09 | H22 | 109.5° | 109.5° |
| H23 | C11 | H24 | 109.5° | 109.5° |
| H25 | C12 | H26 | 109.4° | 109.5° |
| H27 | C14 | H28 | 109.5° | 110.1° |
| H30 | C19 | H31 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C09 | C10 | C11 | H1 | 119.8° | 120.1° |
| C09 | C10 | C11 | H2 | 119.8° | 120.0° |
| C10 | C09 | C08 | C13 | 61.4° | 60.0° |
| C10 | C09 | C08 | C03 | 179.2° | 180.0° |
| C10 | C09 | C08 | H21 | 120.2° | 120.0° |
| C10 | C09 | C08 | H22 | 120.2° | 120.0° |
| C09 | C10 | C11 | C12 | 60.7° | 60.0° |
| C09 | C10 | H1 | H2 | 120.8° | 120.0° |
| C10 | C09 | C08 | H20 | 57.1° | 60.0° |
| C10 | C09 | H21 | H22 | 119.2° | 119.9° |
| C09 | C10 | C11 | H23 | 59.6° | 60.0° |
| C09 | C10 | C11 | H24 | 179.0° | 180.0° |
| C10 | C11 | C12 | C13 | 55.9° | 60.0° |
| C11 | C10 | C09 | C08 | 64.2° | 60.0° |
| C10 | C11 | C12 | H23 | 120.3° | 119.9° |
| C10 | C11 | C12 | H24 | 120.3° | 120.0° |
| C11 | C10 | H1 | H2 | 120.7° | 120.0° |
| C11 | C10 | C09 | H21 | 175.6° | 180.0° |
| C11 | C10 | C09 | H22 | 56.1° | 60.1° |
| C10 | C11 | H23 | H24 | 119.1° | 120.0° |
| C10 | C11 | C12 | H25 | 64.6° | 60.1° |
| C10 | C11 | C12 | H26 | 176.3° | 179.9° |
| C08 | C13 | C12 | H3 | 120.1° | 120.0° |
| C08 | C13 | C12 | H4 | 120.1° | 120.1° |
| C13 | C08 | C03 | C04 | 42.6° | 178.7° |
| C13 | C08 | C03 | C09 | 119.4° | 120.0° |
| C13 | C08 | C03 | H20 | 119.4° | 120.0° |
| C13 | C08 | C03 | C14 | 82.1° | 56.7° |
| C13 | C08 | C09 | H20 | 118.4° | 120.0° |
| C08 | C13 | C12 | C11 | 52.1° | 60.0° |
| C08 | C13 | H3 | H4 | 119.7° | 120.1° |
| C13 | C08 | C09 | H21 | 178.4° | 180.0° |
| C13 | C08 | C09 | H22 | 58.9° | 60.0° |
| C08 | C13 | C12 | H25 | 68.4° | 60.0° |
| C08 | C13 | C12 | H26 | 172.5° | 180.0° |
| C13 | C08 | C03 | C02 | 169.3° | 59.3° |
| C12 | C13 | C08 | C03 | 174.7° | 180.0° |
| C12 | C13 | C08 | C09 | 53.4° | 60.0° |
| C13 | C12 | C11 | H25 | 120.4° | 120.0° |
| C13 | C12 | C11 | H26 | 120.4° | 120.0° |
| C12 | C13 | H3 | H4 | 119.7° | 120.0° |
| C12 | C13 | C08 | H20 | 65.0° | 60.0° |
| C13 | C12 | C11 | H23 | 64.4° | 59.9° |
| C13 | C12 | C11 | H24 | 176.1° | 180.0° |
| C13 | C12 | H25 | H26 | 118.7° | 120.0° |
| C14 | C15 | C16 | C31 | 179.8° | 179.7° |
| C14 | C15 | C16 | C17 | 179.9° | 180.0° |
| C15 | C14 | C03 | C04 | 101.7° | 119.3° |
| C15 | C14 | C03 | C08 | 136.4° | 118.7° |
| C15 | C14 | C03 | H27 | 121.6° | 119.2° |
| C15 | C14 | C03 | H28 | 121.6° | 119.2° |
| C14 | C15 | C31 | C29 | 179.8° | 180.0° |
| C14 | C15 | C31 | C02 | 0.4° | 0.0° |
| C15 | C14 | H27 | H28 | 115.0° | 121.6° |
| C14 | C15 | C16 | H29 | 0.1° | 0.1° |
| C15 | C14 | C03 | C02 | 19.5° | 0.4° |
| C15 | C16 | C17 | H29 | 180.0° | 180.0° |
| C15 | C16 | C17 | O18 | 179.9° | 180.0° |
| C15 | C16 | C17 | C27 | 0.6° | 0.1° |
| C16 | C15 | C14 | C03 | 164.9° | 179.9° |
| C16 | C15 | C31 | C29 | 0.0° | 0.2° |
| C16 | C15 | C31 | C02 | 179.5° | 179.7° |
| C16 | C15 | C14 | H27 | 43.4° | 60.8° |
| C16 | C15 | C14 | H28 | 73.5° | 60.8° |
| C31 | C15 | C16 | C17 | 0.3° | 0.3° |
| C15 | C31 | C02 | O01 | 170.4° | 179.9° |
| C31 | C15 | C14 | C03 | 14.9° | 0.2° |
| C15 | C31 | C29 | C27 | 0.2° | 0.1° |
| C15 | C31 | C29 | C02 | 178.8° | 179.9° |
| C15 | C31 | C29 | F30 | 179.8° | 179.7° |
| C31 | C15 | C14 | H27 | 136.5° | 118.9° |
| C31 | C15 | C14 | H28 | 106.6° | 119.4° |
| C31 | C15 | C16 | H29 | 179.7° | 179.8° |
| C15 | C31 | C02 | C03 | 9.7° | 0.3° |
| C16 | C17 | O18 | C27 | 179.6° | 179.9° |
| C16 | C17 | O18 | C19 | 162.0° | 0.0° |
| C16 | C17 | C27 | C29 | 0.4° | 0.4° |
| C16 | C17 | C27 | F28 | 179.6° | 180.0° |
| C17 | O18 | C19 | C20 | 127.1° | 180.0° |
| O18 | C17 | C27 | C29 | 179.9° | 179.7° |
| O18 | C17 | C27 | F28 | 0.1° | 0.1° |
| O18 | C17 | C16 | H29 | 0.1° | 0.0° |
| C17 | O18 | C19 | H30 | 6.9° | 60.0° |
| C17 | O18 | C19 | H31 | 112.7° | 60.1° |
| C27 | C17 | O18 | C19 | 17.6° | 180.0° |
| C17 | C27 | C29 | F28 | 180.0° | 179.6° |
| C17 | C27 | C29 | C31 | 0.0° | 0.5° |
| C17 | C27 | C29 | F30 | 180.0° | 180.0° |
| C27 | C17 | C16 | H29 | 179.5° | 179.9° |
| C21 | C20 | C19 | H5 | 120.1° | 120.0° |
| C21 | C20 | C19 | H6 | 120.0° | 120.0° |
| C20 | C21 | C22 | H7 | 119.9° | 120.0° |
| C20 | C21 | C22 | H8 | 119.9° | 120.0° |
| C20 | C21 | C22 | N23 | 151.7° | 125.0° |
| C20 | C21 | C22 | N26 | 28.3° | 55.3° |
| C21 | C20 | C19 | O18 | 163.6° | 180.0° |
| C21 | C20 | H5 | H6 | 119.9° | 120.0° |
| C20 | C21 | H7 | H8 | 120.3° | 120.0° |
| C21 | C20 | C19 | H30 | 43.5° | 60.1° |
| C21 | C20 | C19 | H31 | 76.2° | 60.0° |
| C19 | C20 | C21 | C22 | 72.6° | 180.0° |
| C20 | C19 | O18 | H30 | 120.2° | 119.9° |
| C20 | C19 | O18 | H31 | 120.2° | 120.0° |
| C19 | C20 | H5 | H6 | 119.9° | 120.0° |
| C19 | C20 | C21 | H7 | 47.3° | 60.0° |
| C19 | C20 | C21 | H8 | 167.5° | 60.0° |
| C20 | C19 | H30 | H31 | 119.6° | 120.0° |
| C21 | C22 | N23 | N26 | 180.0° | 179.8° |
| C21 | C22 | N23 | N24 | 180.0° | 180.0° |
| C21 | C22 | N26 | N25 | 179.9° | 179.9° |
| C22 | C21 | C20 | H5 | 47.4° | 60.0° |
| C22 | C21 | C20 | H6 | 167.4° | 60.0° |
| C22 | C21 | H7 | H8 | 120.3° | 119.9° |
| C21 | C22 | N23 | H32 | 0.0° | 0.0° |
| C22 | N23 | N24 | H32 | 180.0° | 180.0° |
| C22 | N23 | N24 | N25 | 0.1° | 0.0° |
| N23 | C22 | N26 | N25 | 0.1° | 0.3° |
| N23 | C22 | C21 | H7 | 31.8° | 4.9° |
| N23 | C22 | C21 | H8 | 88.4° | 115.0° |
| N26 | C22 | N23 | N24 | 0.0° | 0.2° |
| C22 | N26 | N25 | N24 | 0.2° | 0.3° |
| N26 | C22 | C21 | H7 | 148.2° | 175.3° |
| N26 | C22 | C21 | H8 | 91.6° | 64.7° |
| N26 | C22 | N23 | H32 | 180.0° | 179.8° |
| O01 | C02 | C03 | C04 | 76.4° | 61.1° |
| O01 | C02 | C03 | C08 | 46.2° | 60.9° |
| O01 | C02 | C03 | C14 | 164.1° | 180.0° |
| O01 | C02 | C31 | C29 | 10.7° | 0.2° |
| O01 | C02 | C31 | C03 | 179.9° | 179.6° |
| C04 | C03 | C08 | C14 | 124.7° | 122.0° |
| C04 | C03 | C08 | C02 | 126.7° | 122.0° |
| C04 | C03 | C14 | C02 | 121.2° | 118.9° |
| C03 | C04 | C05 | H11 | 120.9° | 120.0° |
| C03 | C04 | C05 | H12 | 120.9° | 120.0° |
| C03 | C04 | C05 | C06 | 140.6° | 180.0° |
| C04 | C03 | C08 | C09 | 162.1° | 61.3° |
| C04 | C03 | C02 | C31 | 103.5° | 119.4° |
| C03 | C04 | H11 | H12 | 117.2° | 119.9° |
| C03 | C04 | C05 | H13 | 99.4° | 60.0° |
| C03 | C04 | C05 | H14 | 20.5° | 60.0° |
| C04 | C03 | C08 | H20 | 76.7° | 58.7° |
| C04 | C03 | C14 | H27 | 19.9° | 0.1° |
| C04 | C03 | C14 | H28 | 136.7° | 121.5° |
| C08 | C03 | C14 | C02 | 116.9° | 119.0° |
| C08 | C03 | C04 | C05 | 161.3° | 178.8° |
| C03 | C08 | C09 | H20 | 122.1° | 120.0° |
| C08 | C03 | C02 | C31 | 133.9° | 118.7° |
| C03 | C08 | C13 | H3 | 65.2° | 60.0° |
| C03 | C08 | C13 | H4 | 54.6° | 60.0° |
| C08 | C03 | C04 | H11 | 77.8° | 58.7° |
| C08 | C03 | C04 | H12 | 40.5° | 61.3° |
| C03 | C08 | C09 | H21 | 59.0° | 60.0° |
| C03 | C08 | C09 | H22 | 60.6° | 60.0° |
| C08 | C03 | C14 | H27 | 102.0° | 122.2° |
| C08 | C03 | C14 | H28 | 14.9° | 0.5° |
| C14 | C03 | C04 | C05 | 74.0° | 56.7° |
| C14 | C03 | C08 | C09 | 37.4° | 176.7° |
| C14 | C03 | C02 | C31 | 16.0° | 0.4° |
| C14 | C03 | C04 | H11 | 46.8° | 63.4° |
| C14 | C03 | C04 | H12 | 165.1° | 176.6° |
| C14 | C03 | C08 | H20 | 158.6° | 63.3° |
| C03 | C14 | H27 | H28 | 115.0° | 121.6° |
| C04 | C05 | C06 | H13 | 120.0° | 120.0° |
| C04 | C05 | C06 | H14 | 120.0° | 120.0° |
| C04 | C05 | C06 | C07 | 42.1° | 180.0° |
| C05 | C04 | H11 | H12 | 117.3° | 120.1° |
| C04 | C05 | H13 | H14 | 119.9° | 120.0° |
| C04 | C05 | C06 | H15 | 162.2° | 60.0° |
| C04 | C05 | C06 | H16 | 77.9° | 60.0° |
| C05 | C04 | C03 | C02 | 36.9° | 59.3° |
| C05 | C06 | C07 | H15 | 120.1° | 120.0° |
| C05 | C06 | C07 | H16 | 120.1° | 120.0° |
| C06 | C05 | C04 | H11 | 19.7° | 60.0° |
| C06 | C05 | C04 | H12 | 98.5° | 60.0° |
| C06 | C05 | H13 | H14 | 119.9° | 120.0° |
| C05 | C06 | H15 | H16 | 119.8° | 120.0° |
| C05 | C06 | C07 | H17 | 180.0° | 180.0° |
| C05 | C06 | C07 | H18 | 60.0° | 60.1° |
| C05 | C06 | C07 | H19 | 60.0° | 60.0° |
| C07 | C06 | C05 | H13 | 77.9° | 60.0° |
| C07 | C06 | C05 | H14 | 162.2° | 60.0° |
| C07 | C06 | H15 | H16 | 119.8° | 120.0° |
| C06 | C07 | H17 | H18 | 120.0° | 120.0° |
| C06 | C07 | H17 | H19 | 120.0° | 120.0° |
| C06 | C07 | H18 | H19 | 120.0° | 120.1° |
| C08 | C09 | C10 | H1 | 176.1° | 180.0° |
| C08 | C09 | C10 | H2 | 55.6° | 60.0° |
| C09 | C08 | C13 | H3 | 173.5° | 179.9° |
| C09 | C08 | C13 | H4 | 66.7° | 60.0° |
| C08 | C09 | H21 | H22 | 119.3° | 120.0° |
| C09 | C08 | C03 | C02 | 71.3° | 60.7° |
| C12 | C11 | C10 | H1 | 179.6° | 180.0° |
| C12 | C11 | C10 | H2 | 59.1° | 60.0° |
| C11 | C12 | C13 | H3 | 172.2° | 180.0° |
| C11 | C12 | C13 | H4 | 68.0° | 60.0° |
| C12 | C11 | H23 | H24 | 119.1° | 120.1° |
| C11 | C12 | H25 | H26 | 118.7° | 120.0° |
| O18 | C19 | C20 | H5 | 76.3° | 60.0° |
| O18 | C19 | C20 | H6 | 43.6° | 60.0° |
| O18 | C19 | H30 | H31 | 119.5° | 120.0° |
| N23 | N24 | N25 | N26 | 0.2° | 0.2° |
| N25 | N24 | N23 | H32 | 179.9° | 180.0° |
| C27 | C29 | C31 | F30 | 180.0° | 179.6° |
| C27 | C29 | C31 | C02 | 179.0° | 179.9° |
| F28 | C27 | C29 | C31 | 180.0° | 180.0° |
| F28 | C27 | C29 | F30 | 0.0° | 0.4° |
| C29 | C31 | C02 | C03 | 169.2° | 179.8° |
| F30 | C29 | C31 | C02 | 1.0° | 0.4° |
| H1 | C10 | C09 | H21 | 55.8° | 60.0° |
| H1 | C10 | C09 | H22 | 63.7° | 60.0° |
| H1 | C10 | C11 | H23 | 60.2° | 60.1° |
| H1 | C10 | C11 | H24 | 59.3° | 59.9° |
| H2 | C10 | C09 | H21 | 64.7° | 60.0° |
| H2 | C10 | C09 | H22 | 175.8° | 180.0° |
| H2 | C10 | C11 | H23 | 179.4° | 180.0° |
| H2 | C10 | C11 | H24 | 61.2° | 60.0° |
| H3 | C13 | C08 | H20 | 55.1° | 60.0° |
| H3 | C13 | C12 | H25 | 51.7° | 59.9° |
| H3 | C13 | C12 | H26 | 67.4° | 60.0° |
| H4 | C13 | C08 | H20 | 174.9° | 180.0° |
| H4 | C13 | C12 | H25 | 171.5° | 179.9° |
| H4 | C13 | C12 | H26 | 52.4° | 60.0° |
| H5 | C20 | C21 | H7 | 167.3° | 60.0° |
| H5 | C20 | C21 | H8 | 72.5° | 180.0° |
| H5 | C20 | C19 | H30 | 163.6° | 180.0° |
| H5 | C20 | C19 | H31 | 43.8° | 59.9° |
| H6 | C20 | C21 | H7 | 72.7° | 180.0° |
| H6 | C20 | C21 | H8 | 47.5° | 60.0° |
| H6 | C20 | C19 | H30 | 76.5° | 60.0° |
| H6 | C20 | C19 | H31 | 163.7° | 180.0° |
| H11 | C04 | C05 | H13 | 139.8° | 180.0° |
| H11 | C04 | C05 | H14 | 100.3° | 60.0° |
| H11 | C04 | C03 | C02 | 157.8° | 179.3° |
| H12 | C04 | C05 | H13 | 21.5° | 59.9° |
| H12 | C04 | C05 | H14 | 141.4° | 180.0° |
| H12 | C04 | C03 | C02 | 84.0° | 60.7° |
| H13 | C05 | C06 | H15 | 42.2° | 180.0° |
| H13 | C05 | C06 | H16 | 162.1° | 60.0° |
| H14 | C05 | C06 | H15 | 77.7° | 60.0° |
| H14 | C05 | C06 | H16 | 42.1° | 180.0° |
| H15 | C06 | C07 | H17 | 59.9° | 60.0° |
| H15 | C06 | C07 | H18 | 179.9° | 179.9° |
| H15 | C06 | C07 | H19 | 60.1° | 60.0° |
| H16 | C06 | C07 | H17 | 60.0° | 59.9° |
| H16 | C06 | C07 | H18 | 60.0° | 60.0° |
| H16 | C06 | C07 | H19 | 180.0° | 180.0° |
| H17 | C07 | H18 | H19 | 120.0° | 120.0° |
| H20 | C08 | C09 | H21 | 63.2° | 60.0° |
| H20 | C08 | C09 | H22 | 177.3° | 180.0° |
| H20 | C08 | C03 | C02 | 49.9° | 179.3° |
| H23 | C11 | C12 | H25 | 175.1° | 179.9° |
| H23 | C11 | C12 | H26 | 56.0° | 60.0° |
| H24 | C11 | C12 | H25 | 55.7° | 60.0° |
| H24 | C11 | C12 | H26 | 63.5° | 60.0° |
| H27 | C14 | C03 | C02 | 141.1° | 118.8° |
| H28 | C14 | C03 | C02 | 102.0° | 119.6° |
