UXZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C07 | C08 | sing | 1.51Å | 1.49Å | |
| C07 | N06 | sing | 1.47Å | 1.49Å | |
| C34 | N06 | sing | 1.47Å | 1.49Å | |
| C34 | C35 | sing | 1.53Å | 1.54Å | |
| C08 | C09 | doub | 1.38Å | 1.39Å | Aromatic |
| C08 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | C02 | sing | 1.53Å | 1.55Å | |
| N06 | C05 | sing | 1.47Å | 1.48Å | |
| C09 | C10 | sing | 1.38Å | 1.42Å | Aromatic |
| C35 | C02 | sing | 1.53Å | 1.54Å | |
| C05 | C04 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | doub | 1.38Å | 1.42Å | Aromatic |
| C10 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C02 | C04 | sing | 1.53Å | 1.55Å | |
| C02 | C03 | sing | 1.53Å | 1.51Å | |
| C12 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | N14 | sing | 1.40Å | 1.42Å | |
| C28 | N27 | sing | 1.47Å | 1.46Å | |
| N14 | C31 | sing | 1.47Å | 1.47Å | |
| N14 | C15 | sing | 1.47Å | 1.46Å | |
| C31 | C32 | sing | 1.50Å | 1.55Å | |
| N27 | C26 | sing | 1.39Å | 1.42Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C18 | N21 | sing | 1.47Å | 1.43Å | |
| C32 | O33 | doub | 1.21Å | 1.22Å | |
| C32 | N30 | sing | 1.34Å | 1.42Å | |
| C29 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| C29 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C26 | N25 | sing | 1.33Å | 1.35Å | Aromatic |
| C16 | N30 | sing | 1.46Å | 1.41Å | |
| C16 | C19 | sing | 1.53Å | 1.46Å | |
| N21 | C22 | sing | 1.39Å | 1.42Å | |
| N21 | C20 | sing | 1.47Å | 1.50Å | |
| C22 | N23 | doub | 1.33Å | 1.36Å | Aromatic |
| N25 | C24 | doub | 1.32Å | 1.37Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.57Å | |
| N23 | C24 | sing | 1.32Å | 1.38Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.08Å | 1.08Å | |
| C28 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C03 | H15 | sing | 1.09Å | 1.10Å | |
| C03 | H16 | sing | 1.09Å | 1.10Å | |
| C03 | H17 | sing | 1.09Å | 1.10Å | |
| C04 | H18 | sing | 1.09Å | 1.10Å | |
| C04 | H19 | sing | 1.09Å | 1.10Å | |
| C05 | H20 | sing | 1.09Å | 1.10Å | |
| C05 | H21 | sing | 1.09Å | 1.10Å | |
| C07 | H22 | sing | 1.09Å | 1.10Å | |
| C07 | H23 | sing | 1.09Å | 1.10Å | |
| C09 | H24 | sing | 1.08Å | 1.08Å | |
| C11 | H25 | sing | 1.08Å | 1.08Å | |
| C12 | H26 | sing | 1.08Å | 1.08Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H31 | sing | 1.08Å | 1.08Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| N27 | H39 | sing | 0.97Å | 1.00Å | |
| N30 | H40 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C08 | C07 | N06 | 105.5° | 109.5° |
| C07 | C08 | C09 | 122.6° | 119.9° |
| C07 | C08 | C11 | 119.3° | 119.9° |
| C08 | C07 | H22 | 110.4° | 109.5° |
| C08 | C07 | H23 | 110.4° | 109.5° |
| C07 | N06 | C34 | 109.6° | 111.0° |
| C07 | N06 | C05 | 110.4° | 111.0° |
| N06 | C07 | H22 | 110.5° | 109.5° |
| N06 | C07 | H23 | 110.4° | 109.4° |
| N06 | C34 | C35 | 111.2° | 109.5° |
| C34 | N06 | C05 | 107.4° | 111.2° |
| N06 | C34 | H34 | 109.0° | 109.5° |
| N06 | C34 | H35 | 109.0° | 109.5° |
| C34 | C35 | C02 | 109.0° | 109.3° |
| C35 | C34 | H34 | 109.1° | 109.5° |
| C35 | C34 | H35 | 109.0° | 109.5° |
| C34 | C35 | H36 | 109.6° | 109.5° |
| C34 | C35 | H37 | 109.6° | 109.5° |
| C09 | C08 | C11 | 118.1° | 120.1° |
| C08 | C09 | C10 | 121.1° | 120.1° |
| C08 | C09 | H24 | 119.4° | 119.9° |
| C08 | C11 | C12 | 120.5° | 120.1° |
| C08 | C11 | H25 | 119.8° | 120.0° |
| C01 | C02 | C35 | 107.7° | 109.5° |
| C01 | C02 | C04 | 109.1° | 109.5° |
| C01 | C02 | C03 | 108.4° | 109.6° |
| C02 | C01 | H12 | 109.5° | 109.5° |
| C02 | C01 | H13 | 109.5° | 109.4° |
| C02 | C01 | H14 | 109.5° | 109.5° |
| N06 | C05 | C04 | 107.6° | 109.6° |
| N06 | C05 | H20 | 110.0° | 109.5° |
| N06 | C05 | H21 | 109.9° | 109.5° |
| C09 | C10 | C13 | 121.6° | 120.0° |
| C09 | C10 | H1 | 119.2° | 120.0° |
| C10 | C09 | H24 | 119.5° | 120.0° |
| C35 | C02 | C04 | 109.3° | 109.1° |
| C35 | C02 | C03 | 112.5° | 109.6° |
| C02 | C35 | H36 | 109.6° | 109.5° |
| C02 | C35 | H37 | 109.6° | 109.5° |
| C05 | C04 | C02 | 109.9° | 109.3° |
| C05 | C04 | H18 | 109.4° | 109.5° |
| C05 | C04 | H19 | 109.3° | 109.5° |
| C04 | C05 | H20 | 109.9° | 109.4° |
| C04 | C05 | H21 | 109.9° | 109.5° |
| C11 | C12 | C13 | 122.1° | 119.9° |
| C12 | C11 | H25 | 119.7° | 119.9° |
| C11 | C12 | H26 | 118.9° | 120.0° |
| C10 | C13 | C12 | 116.6° | 119.8° |
| C10 | C13 | N14 | 124.1° | 120.1° |
| C13 | C10 | H1 | 119.2° | 120.1° |
| C04 | C02 | C03 | 109.7° | 109.5° |
| C02 | C04 | H18 | 109.4° | 109.5° |
| C02 | C04 | H19 | 109.3° | 109.5° |
| C02 | C03 | H15 | 109.5° | 109.4° |
| C02 | C03 | H16 | 109.5° | 109.5° |
| C02 | C03 | H17 | 109.5° | 109.4° |
| C12 | C13 | N14 | 119.3° | 120.1° |
| C13 | C12 | H26 | 118.9° | 120.1° |
| C13 | N14 | C31 | 119.5° | 111.0° |
| C13 | N14 | C15 | 119.8° | 111.0° |
| C28 | N27 | C26 | 126.7° | 120.0° |
| N27 | C28 | H9 | 109.5° | 109.4° |
| N27 | C28 | H10 | 109.4° | 109.5° |
| N27 | C28 | H11 | 109.4° | 109.5° |
| C28 | N27 | H39 | 105.0° | 120.0° |
| C31 | N14 | C15 | 111.2° | 110.1° |
| N14 | C31 | C32 | 114.5° | 110.0° |
| N14 | C31 | H32 | 108.2° | 109.4° |
| N14 | C31 | H33 | 108.2° | 109.3° |
| N14 | C15 | C16 | 111.8° | 108.7° |
| N14 | C15 | H2 | 108.9° | 109.6° |
| N14 | C15 | H3 | 108.9° | 109.8° |
| C31 | C32 | O33 | 124.3° | 118.6° |
| C31 | C32 | N30 | 119.7° | 122.8° |
| C32 | C31 | H32 | 108.2° | 109.4° |
| C32 | C31 | H33 | 108.2° | 109.4° |
| N27 | C26 | C29 | 123.3° | 120.5° |
| N27 | C26 | N25 | 114.1° | 120.5° |
| C26 | N27 | H39 | 105.0° | 120.0° |
| C18 | C17 | C16 | 120.7° | 109.3° |
| C17 | C18 | N21 | 112.3° | 109.5° |
| C18 | C17 | H4 | 106.6° | 109.5° |
| C18 | C17 | H5 | 106.6° | 109.5° |
| C17 | C18 | H27 | 108.8° | 109.5° |
| C17 | C18 | H28 | 108.7° | 109.5° |
| C17 | C16 | C15 | 109.7° | 109.3° |
| C17 | C16 | N30 | 102.5° | 109.6° |
| C17 | C16 | C19 | 109.6° | 109.1° |
| C16 | C17 | H4 | 106.6° | 109.6° |
| C16 | C17 | H5 | 106.6° | 109.5° |
| C18 | N21 | C22 | 119.2° | 111.0° |
| C18 | N21 | C20 | 118.5° | 111.3° |
| N21 | C18 | H27 | 108.7° | 109.5° |
| N21 | C18 | H28 | 108.7° | 109.4° |
| O33 | C32 | N30 | 116.0° | 118.6° |
| C32 | N30 | C16 | 122.0° | 122.9° |
| C32 | N30 | H40 | 119.0° | 118.6° |
| C26 | C29 | C22 | 117.8° | 118.3° |
| C29 | C26 | N25 | 122.7° | 119.0° |
| C26 | C29 | H31 | 121.1° | 120.8° |
| C29 | C22 | N21 | 119.6° | 120.5° |
| C29 | C22 | N23 | 121.4° | 119.0° |
| C22 | C29 | H31 | 121.1° | 120.9° |
| C15 | C16 | N30 | 110.0° | 109.9° |
| C15 | C16 | C19 | 121.3° | 109.4° |
| C16 | C15 | H2 | 108.9° | 109.6° |
| C16 | C15 | H3 | 108.9° | 109.6° |
| C26 | N25 | C24 | 115.4° | 120.9° |
| N30 | C16 | C19 | 101.9° | 109.6° |
| C16 | N30 | H40 | 119.0° | 118.5° |
| C16 | C19 | C20 | 120.3° | 109.3° |
| C16 | C19 | H29 | 106.7° | 109.5° |
| C16 | C19 | H30 | 106.7° | 109.5° |
| C22 | N21 | C20 | 122.1° | 111.0° |
| N21 | C22 | N23 | 119.0° | 120.5° |
| N21 | C20 | C19 | 115.4° | 109.5° |
| N21 | C20 | H6 | 108.0° | 109.4° |
| N21 | C20 | H7 | 107.9° | 109.5° |
| C22 | N23 | C24 | 116.5° | 120.9° |
| N25 | C24 | N23 | 126.3° | 121.9° |
| N25 | C24 | H8 | 116.9° | 119.0° |
| C19 | C20 | H6 | 108.0° | 109.5° |
| C19 | C20 | H7 | 108.0° | 109.5° |
| C20 | C19 | H29 | 106.7° | 109.6° |
| C20 | C19 | H30 | 106.7° | 109.5° |
| N23 | C24 | H8 | 116.9° | 119.1° |
| H2 | C15 | H3 | 109.5° | 109.6° |
| H4 | C17 | H5 | 109.5° | 109.5° |
| H6 | C20 | H7 | 109.5° | 109.5° |
| H9 | C28 | H10 | 109.5° | 109.5° |
| H9 | C28 | H11 | 109.5° | 109.5° |
| H10 | C28 | H11 | 109.5° | 109.5° |
| H12 | C01 | H13 | 109.5° | 109.5° |
| H12 | C01 | H14 | 109.5° | 109.5° |
| H13 | C01 | H14 | 109.4° | 109.5° |
| H15 | C03 | H16 | 109.4° | 109.5° |
| H15 | C03 | H17 | 109.5° | 109.4° |
| H16 | C03 | H17 | 109.5° | 109.5° |
| H18 | C04 | H19 | 109.5° | 109.5° |
| H20 | C05 | H21 | 109.5° | 109.4° |
| H22 | C07 | H23 | 109.5° | 109.5° |
| H27 | C18 | H28 | 109.5° | 109.5° |
| H29 | C19 | H30 | 109.4° | 109.5° |
| H32 | C31 | H33 | 109.5° | 109.4° |
| H34 | C34 | H35 | 109.5° | 109.4° |
| H36 | C35 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C08 | C07 | N06 | H22 | 119.4° | 120.0° |
| C08 | C07 | N06 | H23 | 119.4° | 120.0° |
| C08 | C07 | N06 | C34 | 171.0° | 170.0° |
| C07 | C08 | C09 | C11 | 177.4° | 179.5° |
| C08 | C07 | N06 | C05 | 70.9° | 65.8° |
| C07 | C08 | C09 | C10 | 177.9° | 180.0° |
| C07 | C08 | C11 | C12 | 178.7° | 179.7° |
| C08 | C07 | H22 | H23 | 121.8° | 120.0° |
| C07 | C08 | C09 | H24 | 2.1° | 0.0° |
| C07 | C08 | C11 | H25 | 1.3° | 0.1° |
| C07 | N06 | C34 | C05 | 119.9° | 124.1° |
| C07 | N06 | C34 | C35 | 174.4° | 174.2° |
| N06 | C07 | C08 | C09 | 103.7° | 90.0° |
| N06 | C07 | C08 | C11 | 73.7° | 89.5° |
| C07 | N06 | C05 | C04 | 173.7° | 174.2° |
| C07 | N06 | C05 | H20 | 54.0° | 65.8° |
| C07 | N06 | C05 | H21 | 66.6° | 54.1° |
| N06 | C07 | H22 | H23 | 121.8° | 120.0° |
| C07 | N06 | C34 | H34 | 65.4° | 54.1° |
| C07 | N06 | C34 | H35 | 54.1° | 65.8° |
| N06 | C34 | C35 | H34 | 120.2° | 120.0° |
| N06 | C34 | C35 | H35 | 120.3° | 120.0° |
| N06 | C34 | C35 | C02 | 58.4° | 59.2° |
| C34 | N06 | C05 | C04 | 66.8° | 61.7° |
| C34 | N06 | C05 | H20 | 173.5° | 58.3° |
| C34 | N06 | C05 | H21 | 52.9° | 178.2° |
| C34 | N06 | C07 | H22 | 69.6° | 70.0° |
| C34 | N06 | C07 | H23 | 51.7° | 50.0° |
| N06 | C34 | H34 | H35 | 119.2° | 120.0° |
| N06 | C34 | C35 | H36 | 178.4° | 60.7° |
| N06 | C34 | C35 | H37 | 61.5° | 179.1° |
| C34 | C35 | C02 | C01 | 65.7° | 62.2° |
| C35 | C34 | N06 | C05 | 65.7° | 61.7° |
| C34 | C35 | C02 | H36 | 120.0° | 120.0° |
| C34 | C35 | C02 | H37 | 119.9° | 120.0° |
| C34 | C35 | C02 | C04 | 52.7° | 57.6° |
| C34 | C35 | C02 | C03 | 174.8° | 177.6° |
| C35 | C34 | H34 | H35 | 119.2° | 120.0° |
| C34 | C35 | H36 | H37 | 120.2° | 120.1° |
| C08 | C09 | C10 | H24 | 180.0° | 180.0° |
| C09 | C08 | C11 | C12 | 1.2° | 0.8° |
| C08 | C09 | C10 | C13 | 0.5° | 0.0° |
| C08 | C09 | C10 | H1 | 179.5° | 179.7° |
| C09 | C08 | C07 | H22 | 15.7° | 150.0° |
| C09 | C08 | C07 | H23 | 137.0° | 30.0° |
| C09 | C08 | C11 | H25 | 178.8° | 179.5° |
| C11 | C08 | C09 | C10 | 0.5° | 0.5° |
| C08 | C11 | C12 | H25 | 180.0° | 179.8° |
| C08 | C11 | C12 | C13 | 1.0° | 0.5° |
| C11 | C08 | C07 | H22 | 167.0° | 30.5° |
| C11 | C08 | C07 | H23 | 45.7° | 150.5° |
| C11 | C08 | C09 | H24 | 179.5° | 179.5° |
| C08 | C11 | C12 | H26 | 179.0° | 180.0° |
| C01 | C02 | C35 | C04 | 118.4° | 119.9° |
| C01 | C02 | C35 | C03 | 119.5° | 120.2° |
| C01 | C02 | C04 | C05 | 61.1° | 62.3° |
| C01 | C02 | C04 | C03 | 118.6° | 120.2° |
| C02 | C01 | H12 | H13 | 120.0° | 120.0° |
| C02 | C01 | H12 | H14 | 120.0° | 120.0° |
| C02 | C01 | H13 | H14 | 120.0° | 120.0° |
| C01 | C02 | C03 | H15 | 180.0° | 60.0° |
| C01 | C02 | C03 | H16 | 60.0° | 180.0° |
| C01 | C02 | C03 | H17 | 60.0° | 60.0° |
| C01 | C02 | C04 | H18 | 178.8° | 57.7° |
| C01 | C02 | C04 | H19 | 58.9° | 177.8° |
| C01 | C02 | C35 | H36 | 54.3° | 177.8° |
| C01 | C02 | C35 | H37 | 174.4° | 57.8° |
| N06 | C05 | C04 | H20 | 119.7° | 120.0° |
| N06 | C05 | C04 | H21 | 119.7° | 120.1° |
| N06 | C05 | C04 | C02 | 63.6° | 59.1° |
| N06 | C05 | C04 | H18 | 56.5° | 179.1° |
| N06 | C05 | C04 | H19 | 176.4° | 60.8° |
| N06 | C05 | H20 | H21 | 120.9° | 120.0° |
| C05 | N06 | C07 | H22 | 48.5° | 54.3° |
| C05 | N06 | C07 | H23 | 169.8° | 174.2° |
| C05 | N06 | C34 | H34 | 54.6° | 178.3° |
| C05 | N06 | C34 | H35 | 174.1° | 58.3° |
| C09 | C10 | C13 | H1 | 180.0° | 179.7° |
| C09 | C10 | C13 | C12 | 0.8° | 0.3° |
| C09 | C10 | C13 | N14 | 179.3° | 179.8° |
| C35 | C02 | C04 | C05 | 56.5° | 57.6° |
| C35 | C02 | C04 | C03 | 123.8° | 120.0° |
| C35 | C02 | C01 | H12 | 180.0° | 59.6° |
| C35 | C02 | C01 | H13 | 60.0° | 60.3° |
| C35 | C02 | C01 | H14 | 60.0° | 179.7° |
| C35 | C02 | C03 | H15 | 60.9° | 60.2° |
| C35 | C02 | C03 | H16 | 179.1° | 59.8° |
| C35 | C02 | C03 | H17 | 59.1° | 179.9° |
| C35 | C02 | C04 | H18 | 63.6° | 177.6° |
| C35 | C02 | C04 | H19 | 176.5° | 62.4° |
| C02 | C35 | C34 | H34 | 61.8° | 179.2° |
| C02 | C35 | C34 | H35 | 178.7° | 60.8° |
| C02 | C35 | H36 | H37 | 120.2° | 120.0° |
| C05 | C04 | C02 | H18 | 120.1° | 120.0° |
| C05 | C04 | C02 | H19 | 120.0° | 120.0° |
| C05 | C04 | C02 | C03 | 179.7° | 177.6° |
| C05 | C04 | H18 | H19 | 119.8° | 120.1° |
| C04 | C05 | H20 | H21 | 120.9° | 119.9° |
| C11 | C12 | C13 | C10 | 0.0° | 0.0° |
| C11 | C12 | C13 | H26 | 180.0° | 179.5° |
| C11 | C12 | C13 | N14 | 178.6° | 180.0° |
| C10 | C13 | C12 | N14 | 178.6° | 180.0° |
| C10 | C13 | N14 | C31 | 3.4° | 56.1° |
| C10 | C13 | N14 | C15 | 140.1° | 178.9° |
| C13 | C10 | C09 | H24 | 179.5° | 180.0° |
| C10 | C13 | C12 | H26 | 180.0° | 179.5° |
| C04 | C02 | C01 | H12 | 61.4° | 60.0° |
| C04 | C02 | C01 | H13 | 58.6° | 180.0° |
| C04 | C02 | C01 | H14 | 178.6° | 60.0° |
| C04 | C02 | C03 | H15 | 61.0° | 179.9° |
| C04 | C02 | C03 | H16 | 59.0° | 59.9° |
| C04 | C02 | C03 | H17 | 179.0° | 60.2° |
| C02 | C04 | H18 | H19 | 119.8° | 120.1° |
| C02 | C04 | C05 | H20 | 176.7° | 60.9° |
| C02 | C04 | C05 | H21 | 56.1° | 179.2° |
| C04 | C02 | C35 | H36 | 172.7° | 62.3° |
| C04 | C02 | C35 | H37 | 67.2° | 177.6° |
| C03 | C02 | C01 | H12 | 57.9° | 179.8° |
| C03 | C02 | C01 | H13 | 178.0° | 59.9° |
| C03 | C02 | C01 | H14 | 62.1° | 60.1° |
| C02 | C03 | H15 | H16 | 120.0° | 120.0° |
| C02 | C03 | H15 | H17 | 120.0° | 119.9° |
| C02 | C03 | H16 | H17 | 120.0° | 120.0° |
| C03 | C02 | C04 | H18 | 60.2° | 62.4° |
| C03 | C02 | C04 | H19 | 59.7° | 57.6° |
| C03 | C02 | C35 | H36 | 65.2° | 57.6° |
| C03 | C02 | C35 | H37 | 54.9° | 62.4° |
| C12 | C13 | N14 | C31 | 178.1° | 124.0° |
| C12 | C13 | N14 | C15 | 38.3° | 1.1° |
| C12 | C13 | C10 | H1 | 179.2° | 179.9° |
| C13 | C12 | C11 | H25 | 179.0° | 179.7° |
| C13 | N14 | C31 | C15 | 146.5° | 123.4° |
| C13 | N14 | C31 | C32 | 179.7° | 173.6° |
| C13 | N14 | C15 | C16 | 151.1° | 167.6° |
| N14 | C13 | C10 | H1 | 0.7° | 0.1° |
| C13 | N14 | C15 | H2 | 88.5° | 47.8° |
| C13 | N14 | C15 | H3 | 30.7° | 72.5° |
| N14 | C13 | C12 | H26 | 1.4° | 0.5° |
| C13 | N14 | C31 | H32 | 59.6° | 53.4° |
| C13 | N14 | C31 | H33 | 59.0° | 66.3° |
| C28 | N27 | C26 | H39 | 122.3° | 179.9° |
| C28 | N27 | C26 | C29 | 36.6° | 0.1° |
| C28 | N27 | C26 | N25 | 143.4° | 180.0° |
| N27 | C28 | H9 | H10 | 120.0° | 120.0° |
| N27 | C28 | H9 | H11 | 120.0° | 120.0° |
| N27 | C28 | H10 | H11 | 120.0° | 120.0° |
| N14 | C31 | C32 | H32 | 120.7° | 120.2° |
| N14 | C31 | C32 | H33 | 120.7° | 120.0° |
| N14 | C31 | C32 | O33 | 178.0° | 162.9° |
| N14 | C31 | C32 | N30 | 2.0° | 17.1° |
| C31 | N14 | C15 | C16 | 62.6° | 69.1° |
| C31 | N14 | C15 | H2 | 57.8° | 171.2° |
| C31 | N14 | C15 | H3 | 177.1° | 50.8° |
| N14 | C31 | H32 | H33 | 117.7° | 119.6° |
| C15 | N14 | C31 | C32 | 33.3° | 50.3° |
| N14 | C15 | C16 | C17 | 54.0° | 69.8° |
| N14 | C15 | C16 | H2 | 120.4° | 119.8° |
| N14 | C15 | C16 | H3 | 120.3° | 120.0° |
| N14 | C15 | C16 | N30 | 58.1° | 50.5° |
| N14 | C15 | C16 | C19 | 176.7° | 170.8° |
| N14 | C15 | H2 | H3 | 118.9° | 120.5° |
| C15 | N14 | C31 | H32 | 154.0° | 69.9° |
| C15 | N14 | C31 | H33 | 87.4° | 170.4° |
| C31 | C32 | O33 | N30 | 180.0° | 180.0° |
| C31 | C32 | N30 | C16 | 1.3° | 1.7° |
| C32 | C31 | H32 | H33 | 117.7° | 119.8° |
| C31 | C32 | N30 | H40 | 178.7° | 178.3° |
| N27 | C26 | C29 | N25 | 180.0° | 179.9° |
| N27 | C26 | C29 | C22 | 179.8° | 179.9° |
| N27 | C26 | N25 | C24 | 179.7° | 179.9° |
| C26 | N27 | C28 | H9 | 180.0° | 180.0° |
| C26 | N27 | C28 | H10 | 60.0° | 60.0° |
| C26 | N27 | C28 | H11 | 60.0° | 60.1° |
| N27 | C26 | C29 | H31 | 0.2° | 0.1° |
| C18 | C17 | C16 | H4 | 121.5° | 120.0° |
| C18 | C17 | C16 | H5 | 121.6° | 119.9° |
| C17 | C18 | N21 | H27 | 120.4° | 120.1° |
| C17 | C18 | N21 | H28 | 120.4° | 120.0° |
| C18 | C17 | C16 | C15 | 176.4° | 177.4° |
| C18 | C17 | C16 | N30 | 66.7° | 62.1° |
| C18 | C17 | C16 | C19 | 41.0° | 57.8° |
| C17 | C18 | N21 | C22 | 144.1° | 174.2° |
| C17 | C18 | N21 | C20 | 40.3° | 61.6° |
| C18 | C17 | H4 | H5 | 114.9° | 120.0° |
| C17 | C18 | H27 | H28 | 118.7° | 120.0° |
| C16 | C17 | C18 | N21 | 45.4° | 59.2° |
| C17 | C16 | N30 | C32 | 91.4° | 101.9° |
| C17 | C16 | C15 | N30 | 112.0° | 120.3° |
| C17 | C16 | C15 | C19 | 129.3° | 119.3° |
| C17 | C16 | N30 | C19 | 113.4° | 119.6° |
| C17 | C16 | C19 | C20 | 33.0° | 57.9° |
| C17 | C16 | C15 | H2 | 174.3° | 49.9° |
| C17 | C16 | C15 | H3 | 66.4° | 170.2° |
| C16 | C17 | H4 | H5 | 114.9° | 120.1° |
| C16 | C17 | C18 | H27 | 165.9° | 179.3° |
| C16 | C17 | C18 | H28 | 75.0° | 60.7° |
| C17 | C16 | C19 | H29 | 154.5° | 62.1° |
| C17 | C16 | C19 | H30 | 88.6° | 177.8° |
| C17 | C16 | N30 | H40 | 88.6° | 78.2° |
| C18 | N21 | C22 | C29 | 4.0° | 179.7° |
| C18 | N21 | C22 | C20 | 175.4° | 124.3° |
| C18 | N21 | C22 | N23 | 176.6° | 0.1° |
| C18 | N21 | C20 | C19 | 34.3° | 61.6° |
| N21 | C18 | C17 | H4 | 167.0° | 60.8° |
| N21 | C18 | C17 | H5 | 76.1° | 179.2° |
| C18 | N21 | C20 | H6 | 155.2° | 58.3° |
| C18 | N21 | C20 | H7 | 86.6° | 178.3° |
| N21 | C18 | H27 | H28 | 118.7° | 119.9° |
| O33 | C32 | N30 | C16 | 178.7° | 178.3° |
| O33 | C32 | C31 | H32 | 57.3° | 77.0° |
| O33 | C32 | C31 | H33 | 61.2° | 42.8° |
| O33 | C32 | N30 | H40 | 1.3° | 1.8° |
| C32 | N30 | C16 | C15 | 25.2° | 18.3° |
| C32 | N30 | C16 | H40 | 180.0° | 179.9° |
| C32 | N30 | C16 | C19 | 155.2° | 138.5° |
| N30 | C32 | C31 | H32 | 122.7° | 103.0° |
| N30 | C32 | C31 | H33 | 118.8° | 137.2° |
| C26 | C29 | C22 | H31 | 180.0° | 180.0° |
| C26 | C29 | C22 | N21 | 179.4° | 179.6° |
| C26 | C29 | C22 | N23 | 0.0° | 0.0° |
| C29 | C26 | N25 | C24 | 0.2° | 0.0° |
| C29 | C26 | N27 | H39 | 85.7° | 180.0° |
| C22 | C29 | C26 | N25 | 0.1° | 0.0° |
| C29 | C22 | N21 | N23 | 179.4° | 179.6° |
| C29 | C22 | N21 | C20 | 171.4° | 55.4° |
| C29 | C22 | N23 | C24 | 0.0° | 0.1° |
| C15 | C16 | N30 | C19 | 129.9° | 120.2° |
| C15 | C16 | C19 | C20 | 162.4° | 177.4° |
| C16 | C15 | H2 | H3 | 118.9° | 120.3° |
| C15 | C16 | C17 | H4 | 62.0° | 57.4° |
| C15 | C16 | C17 | H5 | 54.9° | 62.7° |
| C15 | C16 | C19 | H29 | 76.1° | 57.4° |
| C15 | C16 | C19 | H30 | 40.8° | 62.7° |
| C15 | C16 | N30 | H40 | 154.8° | 161.7° |
| C26 | N25 | C24 | N23 | 0.2° | 0.0° |
| C26 | N25 | C24 | H8 | 179.8° | 180.0° |
| N25 | C26 | C29 | H31 | 179.9° | 180.0° |
| N25 | C26 | N27 | H39 | 94.3° | 0.1° |
| N30 | C16 | C19 | C20 | 75.1° | 62.1° |
| N30 | C16 | C15 | H2 | 62.3° | 170.2° |
| N30 | C16 | C15 | H3 | 178.4° | 69.5° |
| N30 | C16 | C17 | H4 | 54.9° | 178.0° |
| N30 | C16 | C17 | H5 | 171.8° | 57.8° |
| N30 | C16 | C19 | H29 | 46.4° | 178.0° |
| N30 | C16 | C19 | H30 | 163.3° | 57.9° |
| C16 | C19 | C20 | N21 | 31.2° | 59.2° |
| C16 | C19 | C20 | H29 | 121.5° | 119.9° |
| C16 | C19 | C20 | H30 | 121.5° | 119.9° |
| C19 | C16 | C15 | H2 | 56.3° | 69.4° |
| C19 | C16 | C15 | H3 | 63.0° | 50.8° |
| C19 | C16 | C17 | H4 | 162.5° | 62.1° |
| C19 | C16 | C17 | H5 | 80.6° | 177.7° |
| C16 | C19 | C20 | H6 | 152.1° | 60.7° |
| C16 | C19 | C20 | H7 | 89.6° | 179.3° |
| C16 | C19 | H29 | H30 | 115.1° | 120.1° |
| C19 | C16 | N30 | H40 | 24.8° | 41.5° |
| C22 | N21 | C20 | C19 | 150.3° | 174.2° |
| N21 | C22 | N23 | C24 | 179.4° | 179.7° |
| C22 | N21 | C20 | H6 | 29.4° | 65.9° |
| C22 | N21 | C20 | H7 | 88.9° | 54.1° |
| C22 | N21 | C18 | H27 | 23.7° | 54.1° |
| C22 | N21 | C18 | H28 | 95.4° | 65.8° |
| N21 | C22 | C29 | H31 | 0.6° | 0.3° |
| C20 | N21 | C22 | N23 | 8.0° | 124.2° |
| N21 | C20 | C19 | H6 | 120.9° | 120.0° |
| N21 | C20 | C19 | H7 | 120.9° | 120.0° |
| N21 | C20 | H6 | H7 | 117.3° | 120.0° |
| C20 | N21 | C18 | H27 | 160.8° | 178.3° |
| C20 | N21 | C18 | H28 | 80.1° | 58.3° |
| N21 | C20 | C19 | H29 | 152.8° | 60.7° |
| N21 | C20 | C19 | H30 | 90.3° | 179.2° |
| C22 | N23 | C24 | N25 | 0.1° | 0.1° |
| C22 | N23 | C24 | H8 | 179.9° | 180.0° |
| N23 | C22 | C29 | H31 | 180.0° | 180.0° |
| N25 | C24 | N23 | H8 | 180.0° | 179.9° |
| C19 | C20 | H6 | H7 | 117.3° | 120.0° |
| C20 | C19 | H29 | H30 | 115.1° | 120.1° |
| H1 | C10 | C09 | H24 | 0.5° | 0.3° |
| H4 | C17 | C18 | H27 | 72.6° | 59.3° |
| H4 | C17 | C18 | H28 | 46.6° | 179.3° |
| H5 | C17 | C18 | H27 | 44.3° | 60.8° |
| H5 | C17 | C18 | H28 | 163.5° | 59.2° |
| H6 | C20 | C19 | H29 | 86.4° | 179.3° |
| H6 | C20 | C19 | H30 | 30.6° | 59.2° |
| H7 | C20 | C19 | H29 | 31.9° | 59.3° |
| H7 | C20 | C19 | H30 | 148.8° | 60.8° |
| H9 | C28 | H10 | H11 | 120.0° | 120.0° |
| H9 | C28 | N27 | H39 | 57.7° | 0.1° |
| H10 | C28 | N27 | H39 | 62.3° | 119.9° |
| H11 | C28 | N27 | H39 | 177.7° | 120.0° |
| H12 | C01 | H13 | H14 | 120.0° | 120.0° |
| H15 | C03 | H16 | H17 | 120.0° | 120.0° |
| H18 | C04 | C05 | H20 | 63.2° | 59.1° |
| H18 | C04 | C05 | H21 | 176.2° | 60.8° |
| H19 | C04 | C05 | H20 | 56.7° | 179.2° |
| H19 | C04 | C05 | H21 | 63.9° | 59.3° |
| H25 | C11 | C12 | H26 | 1.0° | 0.2° |
| H34 | C34 | C35 | H36 | 58.1° | 59.3° |
| H34 | C34 | C35 | H37 | 178.2° | 60.8° |
| H35 | C34 | C35 | H36 | 61.4° | 179.2° |
| H35 | C34 | C35 | H37 | 58.7° | 59.1° |
