XNH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | N1 | sing | 1.29Å | 1.41Å | Aromatic |
| N | C1 | doub | 1.31Å | 1.30Å | Aromatic |
| C | O | sing | 1.43Å | 1.45Å | |
| N1 | C2 | doub | 1.32Å | 1.32Å | Aromatic |
| C1 | O | sing | 1.36Å | 1.33Å | |
| C1 | N3 | sing | 1.36Å | 1.34Å | Aromatic |
| C2 | N3 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.41Å | 1.42Å | Aromatic |
| N3 | N2 | sing | 1.40Å | 1.40Å | Aromatic |
| C3 | C4 | doub | 1.36Å | 1.36Å | Aromatic |
| N2 | C5 | doub | 1.31Å | 1.30Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.43Å | Aromatic |
| C5 | N4 | sing | 1.39Å | 1.41Å | |
| N4 | C6 | sing | 1.47Å | 1.47Å | |
| N4 | C10 | sing | 1.47Å | 1.47Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | C11 | sing | 1.51Å | 1.51Å | |
| C11 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | O1 | sing | 1.36Å | 1.37Å | |
| O1 | C15 | sing | 1.43Å | 1.43Å | |
| C15 | C16 | sing | 1.53Å | 1.50Å | |
| C16 | N5 | sing | 1.47Å | 1.48Å | |
| N5 | C17 | sing | 1.48Å | 1.47Å | |
| N5 | C21 | sing | 1.47Å | 1.47Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | N6 | sing | 1.46Å | 1.46Å | |
| C21 | C20 | sing | 1.50Å | 1.52Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| N6 | C20 | sing | 1.34Å | 1.34Å | |
| N6 | C19 | sing | 1.47Å | 1.46Å | |
| C20 | O2 | doub | 1.21Å | 1.21Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.08Å | 1.08Å | |
| C6 | H29 | sing | 1.09Å | 1.10Å | |
| C6 | H30 | sing | 1.09Å | 1.10Å | |
| C4 | H31 | sing | 1.08Å | 1.08Å | |
| C | H32 | sing | 1.09Å | 1.10Å | |
| C | H33 | sing | 1.09Å | 1.10Å | |
| C | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | N | C1 | 105.4° | 110.2° |
| N | N1 | C2 | 107.3° | 109.5° |
| N | C1 | O | 127.8° | 126.2° |
| N | C1 | N3 | 113.5° | 107.5° |
| C | O | C1 | 116.2° | 117.0° |
| O | C | H32 | 109.5° | 109.5° |
| O | C | H33 | 109.5° | 109.5° |
| O | C | H34 | 109.4° | 109.5° |
| N1 | C2 | N3 | 109.8° | 106.9° |
| N1 | C2 | C3 | 133.8° | 133.8° |
| O | C1 | N3 | 118.7° | 126.3° |
| C1 | N3 | C2 | 103.9° | 105.9° |
| C1 | N3 | N2 | 129.4° | 134.0° |
| N3 | C2 | C3 | 116.3° | 119.3° |
| C2 | N3 | N2 | 126.6° | 120.1° |
| C2 | C3 | C4 | 118.5° | 119.1° |
| C2 | C3 | H1 | 120.7° | 120.5° |
| N3 | N2 | C5 | 113.8° | 120.5° |
| C3 | C4 | C5 | 120.3° | 120.2° |
| C4 | C3 | H1 | 120.8° | 120.4° |
| C3 | C4 | H31 | 119.8° | 119.9° |
| N2 | C5 | C4 | 124.5° | 120.8° |
| N2 | C5 | N4 | 111.2° | 119.6° |
| C4 | C5 | N4 | 124.3° | 119.6° |
| C5 | C4 | H31 | 119.8° | 119.9° |
| C5 | N4 | C6 | 122.3° | 120.6° |
| C5 | N4 | C10 | 124.8° | 120.6° |
| C6 | N4 | C10 | 112.1° | 118.7° |
| N4 | C6 | C7 | 111.7° | 108.8° |
| N4 | C6 | H29 | 108.9° | 109.6° |
| N4 | C6 | H30 | 108.9° | 109.7° |
| N4 | C10 | C9 | 111.9° | 108.8° |
| N4 | C10 | H7 | 108.9° | 109.6° |
| N4 | C10 | H8 | 108.9° | 109.7° |
| C6 | C7 | C8 | 110.6° | 109.3° |
| C6 | C7 | H2 | 109.2° | 109.5° |
| C6 | C7 | H3 | 109.2° | 109.5° |
| C7 | C6 | H29 | 108.9° | 109.5° |
| C7 | C6 | H30 | 108.9° | 109.6° |
| C10 | C9 | C8 | 111.3° | 109.3° |
| C10 | C9 | H5 | 109.0° | 109.5° |
| C10 | C9 | H6 | 109.0° | 109.5° |
| C9 | C10 | H7 | 108.8° | 109.6° |
| C9 | C10 | H8 | 108.8° | 109.5° |
| C7 | C8 | C9 | 108.9° | 109.6° |
| C7 | C8 | C11 | 113.8° | 109.5° |
| C8 | C7 | H2 | 109.2° | 109.5° |
| C8 | C7 | H3 | 109.2° | 109.5° |
| C7 | C8 | H4 | 106.1° | 109.5° |
| C9 | C8 | C11 | 115.2° | 109.4° |
| C9 | C8 | H4 | 106.0° | 109.5° |
| C8 | C9 | H5 | 109.0° | 109.6° |
| C8 | C9 | H6 | 109.0° | 109.5° |
| C8 | C11 | C24 | 121.6° | 119.9° |
| C8 | C11 | C12 | 120.3° | 119.9° |
| C11 | C8 | H4 | 106.1° | 109.4° |
| C24 | C11 | C12 | 118.1° | 120.2° |
| C11 | C24 | C23 | 121.0° | 120.0° |
| C11 | C24 | H22 | 119.5° | 120.0° |
| C11 | C12 | C13 | 121.3° | 120.0° |
| C11 | C12 | H9 | 119.4° | 120.0° |
| C24 | C23 | C14 | 119.7° | 120.0° |
| C23 | C24 | H22 | 119.5° | 120.0° |
| C24 | C23 | H28 | 120.1° | 120.0° |
| C12 | C13 | C14 | 119.7° | 120.0° |
| C13 | C12 | H9 | 119.4° | 120.0° |
| C12 | C13 | H10 | 120.1° | 120.0° |
| C23 | C14 | C13 | 120.0° | 119.9° |
| C23 | C14 | O1 | 128.8° | 120.1° |
| C14 | C23 | H28 | 120.1° | 120.0° |
| C13 | C14 | O1 | 111.1° | 120.0° |
| C14 | C13 | H10 | 120.2° | 120.1° |
| C14 | O1 | C15 | 118.8° | 117.0° |
| O1 | C15 | C16 | 105.1° | 109.5° |
| O1 | C15 | H11 | 110.5° | 109.5° |
| O1 | C15 | H12 | 110.5° | 109.5° |
| C15 | C16 | N5 | 107.6° | 109.5° |
| C16 | C15 | H11 | 110.6° | 109.5° |
| C16 | C15 | H12 | 110.5° | 109.4° |
| C15 | C16 | H13 | 109.9° | 109.5° |
| C15 | C16 | H14 | 109.9° | 109.4° |
| C16 | N5 | C17 | 112.0° | 111.0° |
| C16 | N5 | C21 | 121.7° | 110.8° |
| N5 | C16 | H13 | 109.9° | 109.4° |
| N5 | C16 | H14 | 109.9° | 109.5° |
| C17 | N5 | C21 | 112.3° | 109.9° |
| N5 | C17 | C18 | 111.7° | 108.5° |
| N5 | C17 | H25 | 108.9° | 109.9° |
| N5 | C17 | H26 | 108.9° | 109.6° |
| N5 | C21 | C20 | 113.6° | 110.0° |
| N5 | C21 | C22 | 114.1° | 109.4° |
| N5 | C21 | H18 | 106.8° | 109.4° |
| C17 | C18 | N6 | 114.7° | 110.0° |
| C17 | C18 | H23 | 108.2° | 109.4° |
| C17 | C18 | H24 | 108.2° | 109.3° |
| C18 | C17 | H25 | 108.9° | 109.6° |
| C18 | C17 | H26 | 108.9° | 109.6° |
| C18 | N6 | C20 | 124.4° | 122.9° |
| C18 | N6 | C19 | 115.7° | 118.5° |
| N6 | C18 | H23 | 108.2° | 109.4° |
| N6 | C18 | H24 | 108.1° | 109.3° |
| C20 | C21 | C22 | 109.1° | 109.3° |
| C21 | C20 | N6 | 119.2° | 122.7° |
| C21 | C20 | O2 | 117.8° | 118.7° |
| C20 | C21 | H18 | 106.4° | 109.4° |
| C22 | C21 | H18 | 106.3° | 109.4° |
| C21 | C22 | H19 | 109.5° | 109.5° |
| C21 | C22 | H20 | 109.5° | 109.4° |
| C21 | C22 | H21 | 109.5° | 109.5° |
| C20 | N6 | C19 | 119.9° | 118.6° |
| N6 | C20 | O2 | 122.8° | 118.6° |
| N6 | C19 | H15 | 109.5° | 109.4° |
| N6 | C19 | H16 | 109.5° | 109.5° |
| N6 | C19 | H17 | 109.4° | 109.5° |
| H2 | C7 | H3 | 109.5° | 109.6° |
| H5 | C9 | H6 | 109.4° | 109.6° |
| H7 | C10 | H8 | 109.5° | 109.6° |
| H11 | C15 | H12 | 109.5° | 109.4° |
| H13 | C16 | H14 | 109.5° | 109.4° |
| H15 | C19 | H16 | 109.5° | 109.5° |
| H15 | C19 | H17 | 109.5° | 109.5° |
| H16 | C19 | H17 | 109.4° | 109.5° |
| H19 | C22 | H20 | 109.5° | 109.5° |
| H19 | C22 | H21 | 109.5° | 109.4° |
| H20 | C22 | H21 | 109.5° | 109.5° |
| H23 | C18 | H24 | 109.4° | 109.4° |
| H25 | C17 | H26 | 109.5° | 109.6° |
| H29 | C6 | H30 | 109.5° | 109.7° |
| H32 | C | H33 | 109.5° | 109.5° |
| H32 | C | H34 | 109.5° | 109.4° |
| H33 | C | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | N | C1 | O | 179.8° | 179.9° |
| N1 | N | C1 | N3 | 2.4° | 0.2° |
| N | N1 | C2 | N3 | 1.1° | 0.1° |
| N | N1 | C2 | C3 | 177.4° | 179.9° |
| N | C1 | O | C | 16.6° | 0.3° |
| C1 | N | N1 | C2 | 0.7° | 0.2° |
| N | C1 | O | N3 | 177.7° | 179.7° |
| N | C1 | N3 | C2 | 3.0° | 0.2° |
| N | C1 | N3 | N2 | 178.4° | 179.7° |
| C | O | C1 | N3 | 165.7° | 180.0° |
| O | C | H32 | H33 | 120.0° | 120.1° |
| O | C | H32 | H34 | 120.0° | 119.9° |
| O | C | H33 | H34 | 119.9° | 120.0° |
| N1 | C2 | N3 | C1 | 2.4° | 0.1° |
| N1 | C2 | N3 | C3 | 178.8° | 179.9° |
| N1 | C2 | N3 | N2 | 178.0° | 179.8° |
| N1 | C2 | C3 | C4 | 178.0° | 179.9° |
| N1 | C2 | C3 | H1 | 2.0° | 0.1° |
| O | C1 | N3 | C2 | 179.0° | 179.9° |
| O | C1 | N3 | N2 | 3.6° | 0.0° |
| C1 | O | C | H32 | 180.0° | 60.0° |
| C1 | O | C | H33 | 60.0° | 60.0° |
| C1 | O | C | H34 | 60.0° | 179.9° |
| C1 | N3 | C2 | N2 | 175.6° | 179.9° |
| C1 | N3 | C2 | C3 | 176.4° | 180.0° |
| C1 | N3 | N2 | C5 | 174.3° | 179.9° |
| N3 | C2 | C3 | C4 | 0.4° | 0.1° |
| C2 | N3 | N2 | C5 | 0.2° | 0.1° |
| N3 | C2 | C3 | H1 | 179.6° | 180.0° |
| C3 | C2 | N3 | N2 | 0.8° | 0.1° |
| C2 | C3 | C4 | H1 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.8° | 0.0° |
| C2 | C3 | C4 | H31 | 179.2° | 179.9° |
| N3 | N2 | C5 | C4 | 1.5° | 0.0° |
| N3 | N2 | C5 | N4 | 178.9° | 180.0° |
| C3 | C4 | C5 | N2 | 1.9° | 0.1° |
| C3 | C4 | C5 | H31 | 180.0° | 179.9° |
| C3 | C4 | C5 | N4 | 178.6° | 180.0° |
| N2 | C5 | C4 | N4 | 179.5° | 179.9° |
| N2 | C5 | N4 | C6 | 24.3° | 5.6° |
| N2 | C5 | N4 | C10 | 166.4° | 174.4° |
| N2 | C5 | C4 | H31 | 178.1° | 180.0° |
| C4 | C5 | N4 | C6 | 156.1° | 174.4° |
| C4 | C5 | N4 | C10 | 13.1° | 5.7° |
| C5 | C4 | C3 | H1 | 179.2° | 179.9° |
| C5 | N4 | C6 | C10 | 170.5° | 180.0° |
| C5 | N4 | C6 | C7 | 114.6° | 126.4° |
| C5 | N4 | C10 | C9 | 116.0° | 126.4° |
| C5 | N4 | C10 | H7 | 4.4° | 113.8° |
| C5 | N4 | C10 | H8 | 123.6° | 6.6° |
| C5 | N4 | C6 | H29 | 125.1° | 6.6° |
| C5 | N4 | C6 | H30 | 5.7° | 113.8° |
| N4 | C5 | C4 | H31 | 1.5° | 0.1° |
| N4 | C6 | C7 | H29 | 120.3° | 119.8° |
| N4 | C6 | C7 | H30 | 120.3° | 119.9° |
| C6 | N4 | C10 | C9 | 54.2° | 53.6° |
| N4 | C6 | C7 | C8 | 57.6° | 54.6° |
| N4 | C6 | C7 | H2 | 177.8° | 65.3° |
| N4 | C6 | C7 | H3 | 62.5° | 174.6° |
| C6 | N4 | C10 | H7 | 174.6° | 66.2° |
| C6 | N4 | C10 | H8 | 66.2° | 173.4° |
| N4 | C6 | H29 | H30 | 119.0° | 120.5° |
| C10 | N4 | C6 | C7 | 55.9° | 53.6° |
| N4 | C10 | C9 | H7 | 120.4° | 119.8° |
| N4 | C10 | C9 | H8 | 120.4° | 119.9° |
| N4 | C10 | C9 | C8 | 54.6° | 54.6° |
| N4 | C10 | C9 | H5 | 65.7° | 174.6° |
| N4 | C10 | C9 | H6 | 174.9° | 65.3° |
| N4 | C10 | H7 | H8 | 118.9° | 120.5° |
| C10 | N4 | C6 | H29 | 64.4° | 173.3° |
| C10 | N4 | C6 | H30 | 176.2° | 66.2° |
| C6 | C7 | C8 | H2 | 120.2° | 119.9° |
| C6 | C7 | C8 | H3 | 120.2° | 119.9° |
| C6 | C7 | C8 | C9 | 56.9° | 61.4° |
| C6 | C7 | C8 | C11 | 173.2° | 178.6° |
| C6 | C7 | H2 | H3 | 119.5° | 120.1° |
| C6 | C7 | C8 | H4 | 56.8° | 58.6° |
| C7 | C6 | H29 | H30 | 118.9° | 120.3° |
| C10 | C9 | C8 | C7 | 55.5° | 61.4° |
| C10 | C9 | C8 | H5 | 120.3° | 119.9° |
| C10 | C9 | C8 | H6 | 120.3° | 119.9° |
| C10 | C9 | C8 | C11 | 175.3° | 178.6° |
| C10 | C9 | C8 | H4 | 58.3° | 58.7° |
| C10 | C9 | H5 | H6 | 119.2° | 120.1° |
| C9 | C10 | H7 | H8 | 118.8° | 120.2° |
| C7 | C8 | C9 | C11 | 129.2° | 120.0° |
| C7 | C8 | C9 | H4 | 113.8° | 120.1° |
| C7 | C8 | C11 | H4 | 116.3° | 120.0° |
| C7 | C8 | C11 | C24 | 99.4° | 120.0° |
| C7 | C8 | C11 | C12 | 82.3° | 60.2° |
| C8 | C7 | H2 | H3 | 119.5° | 120.1° |
| C7 | C8 | C9 | H5 | 64.8° | 178.7° |
| C7 | C8 | C9 | H6 | 175.8° | 58.5° |
| C8 | C7 | C6 | H29 | 62.7° | 174.4° |
| C8 | C7 | C6 | H30 | 178.0° | 65.2° |
| C9 | C8 | C11 | H4 | 116.9° | 119.9° |
| C9 | C8 | C11 | C24 | 27.3° | 119.9° |
| C9 | C8 | C11 | C12 | 151.0° | 59.8° |
| C9 | C8 | C7 | H2 | 177.1° | 58.5° |
| C9 | C8 | C7 | H3 | 63.3° | 178.7° |
| C8 | C9 | H5 | H6 | 119.2° | 120.1° |
| C8 | C9 | C10 | H7 | 175.0° | 65.2° |
| C8 | C9 | C10 | H8 | 65.8° | 174.5° |
| C8 | C11 | C24 | C12 | 178.4° | 179.8° |
| C8 | C11 | C24 | C23 | 179.4° | 179.7° |
| C8 | C11 | C12 | C13 | 179.7° | 179.9° |
| C11 | C8 | C7 | H2 | 53.0° | 61.4° |
| C11 | C8 | C7 | H3 | 66.7° | 58.7° |
| C11 | C8 | C9 | H5 | 64.4° | 58.7° |
| C11 | C8 | C9 | H6 | 55.0° | 61.5° |
| C8 | C11 | C12 | H9 | 0.3° | 0.0° |
| C8 | C11 | C24 | H22 | 0.6° | 0.1° |
| C11 | C24 | C23 | H22 | 180.0° | 179.8° |
| C24 | C11 | C12 | C13 | 1.3° | 0.3° |
| C11 | C24 | C23 | C14 | 3.3° | 0.5° |
| C24 | C11 | C8 | H4 | 144.3° | 0.0° |
| C24 | C11 | C12 | H9 | 178.7° | 179.8° |
| C11 | C24 | C23 | H28 | 176.7° | 180.0° |
| C12 | C11 | C24 | C23 | 2.3° | 0.5° |
| C11 | C12 | C13 | H9 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 1.4° | 0.0° |
| C12 | C11 | C8 | H4 | 34.1° | 179.8° |
| C11 | C12 | C13 | H10 | 178.6° | 179.9° |
| C12 | C11 | C24 | H22 | 177.7° | 179.7° |
| C24 | C23 | C14 | H28 | 180.0° | 179.5° |
| C24 | C23 | C14 | C13 | 3.3° | 0.2° |
| C24 | C23 | C14 | O1 | 179.5° | 179.8° |
| C12 | C13 | C14 | C23 | 2.3° | 0.0° |
| C12 | C13 | C14 | H10 | 180.0° | 179.9° |
| C12 | C13 | C14 | O1 | 179.9° | 180.0° |
| C23 | C14 | C13 | O1 | 177.7° | 180.0° |
| C23 | C14 | O1 | C15 | 2.6° | 0.0° |
| C23 | C14 | C13 | H10 | 177.7° | 179.9° |
| C14 | C23 | C24 | H22 | 176.7° | 179.7° |
| C13 | C14 | O1 | C15 | 179.9° | 180.0° |
| C14 | C13 | C12 | H9 | 178.6° | 180.0° |
| C13 | C14 | C23 | H28 | 176.7° | 179.7° |
| C14 | O1 | C15 | C16 | 176.0° | 180.0° |
| O1 | C14 | C13 | H10 | 0.1° | 0.1° |
| C14 | O1 | C15 | H11 | 64.6° | 60.0° |
| C14 | O1 | C15 | H12 | 56.7° | 60.0° |
| O1 | C14 | C23 | H28 | 0.5° | 0.3° |
| O1 | C15 | C16 | H11 | 119.3° | 120.0° |
| O1 | C15 | C16 | H12 | 119.3° | 120.0° |
| O1 | C15 | C16 | N5 | 61.1° | 65.0° |
| O1 | C15 | H11 | H12 | 122.0° | 120.1° |
| O1 | C15 | C16 | H13 | 58.6° | 175.0° |
| O1 | C15 | C16 | H14 | 179.2° | 55.0° |
| C15 | C16 | N5 | H13 | 119.7° | 120.0° |
| C15 | C16 | N5 | H14 | 119.7° | 120.0° |
| C15 | C16 | N5 | C17 | 114.7° | 66.0° |
| C15 | C16 | N5 | C21 | 108.2° | 171.5° |
| C16 | C15 | H11 | H12 | 122.0° | 119.9° |
| C15 | C16 | H13 | H14 | 120.9° | 120.0° |
| C16 | N5 | C17 | C21 | 141.2° | 123.0° |
| C16 | N5 | C17 | C18 | 162.3° | 167.6° |
| C16 | N5 | C21 | C20 | 174.4° | 173.7° |
| C16 | N5 | C21 | C22 | 59.6° | 53.6° |
| N5 | C16 | C15 | H11 | 179.6° | 174.9° |
| N5 | C16 | C15 | H12 | 58.2° | 55.0° |
| N5 | C16 | H13 | H14 | 120.9° | 120.0° |
| C16 | N5 | C21 | H18 | 57.5° | 66.2° |
| C16 | N5 | C17 | H25 | 41.9° | 72.5° |
| C16 | N5 | C17 | H26 | 77.4° | 48.0° |
| N5 | C17 | C18 | H25 | 120.3° | 120.0° |
| N5 | C17 | C18 | H26 | 120.3° | 119.6° |
| N5 | C17 | C18 | N6 | 35.2° | 50.5° |
| C17 | N5 | C21 | C20 | 48.6° | 50.5° |
| C17 | N5 | C21 | C22 | 77.3° | 69.6° |
| C17 | N5 | C16 | H13 | 5.0° | 54.0° |
| C17 | N5 | C16 | H14 | 125.5° | 174.0° |
| C17 | N5 | C21 | H18 | 165.6° | 170.6° |
| N5 | C17 | C18 | H23 | 85.6° | 170.7° |
| N5 | C17 | C18 | H24 | 155.9° | 69.5° |
| N5 | C17 | H25 | H26 | 119.0° | 120.5° |
| C21 | N5 | C17 | C18 | 56.5° | 69.4° |
| N5 | C21 | C20 | C22 | 128.5° | 120.1° |
| N5 | C21 | C20 | H18 | 117.2° | 120.1° |
| N5 | C21 | C22 | H18 | 117.4° | 119.8° |
| N5 | C21 | C20 | N6 | 19.6° | 17.1° |
| N5 | C21 | C20 | O2 | 164.5° | 162.8° |
| C21 | N5 | C16 | H13 | 132.1° | 68.5° |
| C21 | N5 | C16 | H14 | 11.5° | 51.5° |
| N5 | C21 | C22 | H19 | 180.0° | 60.5° |
| N5 | C21 | C22 | H20 | 60.0° | 59.5° |
| N5 | C21 | C22 | H21 | 60.0° | 179.5° |
| C21 | N5 | C17 | H25 | 176.9° | 50.5° |
| C21 | N5 | C17 | H26 | 63.8° | 171.0° |
| C17 | C18 | N6 | H23 | 120.8° | 120.3° |
| C17 | C18 | N6 | H24 | 120.8° | 120.0° |
| C17 | C18 | N6 | C20 | 6.8° | 18.1° |
| C17 | C18 | N6 | C19 | 171.8° | 161.6° |
| C17 | C18 | H23 | H24 | 117.6° | 119.7° |
| C18 | C17 | H25 | H26 | 119.0° | 120.4° |
| C18 | N6 | C20 | C21 | 1.2° | 1.4° |
| C18 | N6 | C20 | C19 | 178.5° | 179.7° |
| C18 | N6 | C20 | O2 | 174.5° | 178.6° |
| C18 | N6 | C19 | H15 | 180.0° | 179.7° |
| C18 | N6 | C19 | H16 | 60.0° | 60.3° |
| C18 | N6 | C19 | H17 | 60.0° | 59.7° |
| N6 | C18 | H23 | H24 | 117.6° | 119.7° |
| N6 | C18 | C17 | H25 | 155.5° | 69.5° |
| N6 | C18 | C17 | H26 | 85.1° | 170.2° |
| C20 | C21 | C22 | H18 | 114.4° | 119.7° |
| C21 | C20 | N6 | O2 | 175.7° | 179.9° |
| C21 | C20 | N6 | C19 | 179.7° | 178.4° |
| C20 | C21 | C22 | H19 | 51.8° | 60.0° |
| C20 | C21 | C22 | H20 | 68.2° | 180.0° |
| C20 | C21 | C22 | H21 | 171.8° | 60.0° |
| C22 | C21 | C20 | N6 | 108.9° | 103.0° |
| C22 | C21 | C20 | O2 | 67.0° | 77.1° |
| C21 | C22 | H19 | H20 | 120.0° | 120.0° |
| C21 | C22 | H19 | H21 | 120.0° | 120.0° |
| C21 | C22 | H20 | H21 | 120.0° | 120.0° |
| C20 | N6 | C19 | H15 | 1.4° | 0.0° |
| C20 | N6 | C19 | H16 | 121.4° | 120.0° |
| C20 | N6 | C19 | H17 | 118.7° | 120.0° |
| N6 | C20 | C21 | H18 | 136.8° | 137.3° |
| C20 | N6 | C18 | H23 | 114.0° | 138.4° |
| C20 | N6 | C18 | H24 | 127.6° | 101.9° |
| C19 | N6 | C20 | O2 | 4.0° | 1.7° |
| N6 | C19 | H15 | H16 | 120.0° | 120.0° |
| N6 | C19 | H15 | H17 | 120.0° | 120.0° |
| N6 | C19 | H16 | H17 | 119.9° | 120.0° |
| C19 | N6 | C18 | H23 | 67.5° | 41.3° |
| C19 | N6 | C18 | H24 | 51.0° | 78.4° |
| O2 | C20 | C21 | H18 | 47.3° | 42.7° |
| H1 | C3 | C4 | H31 | 0.8° | 0.0° |
| H2 | C7 | C8 | H4 | 63.3° | 178.6° |
| H2 | C7 | C6 | H29 | 57.5° | 54.5° |
| H2 | C7 | C6 | H30 | 61.8° | 174.8° |
| H3 | C7 | C8 | H4 | 177.0° | 61.3° |
| H3 | C7 | C6 | H29 | 177.1° | 65.7° |
| H3 | C7 | C6 | H30 | 57.8° | 54.7° |
| H4 | C8 | C9 | H5 | 178.6° | 61.2° |
| H4 | C8 | C9 | H6 | 62.0° | 178.6° |
| H5 | C9 | C10 | H7 | 54.7° | 54.8° |
| H5 | C9 | C10 | H8 | 173.9° | 65.5° |
| H6 | C9 | C10 | H7 | 64.8° | 174.9° |
| H6 | C9 | C10 | H8 | 54.5° | 54.6° |
| H9 | C12 | C13 | H10 | 1.4° | 0.0° |
| H11 | C15 | C16 | H13 | 60.7° | 54.9° |
| H11 | C15 | C16 | H14 | 59.9° | 65.0° |
| H12 | C15 | C16 | H13 | 177.9° | 65.0° |
| H12 | C15 | C16 | H14 | 61.5° | 175.0° |
| H15 | C19 | H16 | H17 | 120.0° | 120.1° |
| H18 | C21 | C22 | H19 | 62.6° | 179.7° |
| H18 | C21 | C22 | H20 | 177.4° | 60.2° |
| H18 | C21 | C22 | H21 | 57.4° | 59.8° |
| H19 | C22 | H20 | H21 | 120.0° | 120.0° |
| H22 | C24 | C23 | H28 | 3.3° | 0.2° |
| H23 | C18 | C17 | H25 | 34.7° | 50.7° |
| H23 | C18 | C17 | H26 | 154.1° | 69.6° |
| H24 | C18 | C17 | H25 | 83.7° | 170.4° |
| H24 | C18 | C17 | H26 | 35.6° | 50.1° |
| H32 | C | H33 | H34 | 120.0° | 119.9° |
