MH4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O23 | C21 | doub | 1.22Å | 1.23Å | |
| C21 | N22 | sing | 1.35Å | 1.36Å | |
| C21 | C20 | sing | 1.48Å | 1.50Å | |
| N22 | C32 | sing | 1.46Å | 1.46Å | |
| C32 | C33 | sing | 1.51Å | 1.52Å | |
| C33 | C38 | doub | 1.39Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.39Å | 1.42Å | Aromatic |
| C38 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | N36 | doub | 1.32Å | 1.37Å | Aromatic |
| N36 | C35 | sing | 1.32Å | 1.36Å | Aromatic |
| C35 | C39 | sing | 1.51Å | 1.51Å | |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C16 | sing | 1.40Å | 1.39Å | Aromatic |
| C20 | N19 | doub | 1.32Å | 1.34Å | Aromatic |
| C16 | C8 | sing | 1.50Å | 1.53Å | |
| C16 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| N19 | N18 | sing | 1.29Å | 1.38Å | Aromatic |
| N18 | C24 | sing | 1.47Å | 1.49Å | |
| N18 | C17 | sing | 1.35Å | 1.33Å | Aromatic |
| C17 | C10 | sing | 1.47Å | 1.40Å | Aromatic |
| C10 | N15 | sing | 1.32Å | 1.34Å | Aromatic |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| N15 | C14 | doub | 1.33Å | 1.34Å | Aromatic |
| C14 | N13 | sing | 1.33Å | 1.35Å | Aromatic |
| C14 | N1 | sing | 1.39Å | 1.37Å | |
| N13 | C12 | doub | 1.32Å | 1.34Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C9 | sing | 1.50Å | 1.50Å | |
| N1 | C2 | sing | 1.40Å | 1.35Å | |
| C2 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.41Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | N25 | sing | 1.40Å | 1.43Å | |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| N25 | C30 | sing | 1.47Å | 1.47Å | |
| N25 | C26 | sing | 1.47Å | 1.47Å | |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| C29 | N28 | sing | 1.47Å | 1.48Å | |
| N28 | C31 | sing | 1.47Å | 1.50Å | |
| N28 | C27 | sing | 1.47Å | 1.48Å | |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| N22 | H22 | sing | 0.97Å | 1.00Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.09Å | 1.10Å | |
| C39 | H392 | sing | 1.09Å | 1.10Å | |
| C39 | H393 | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C9 | H91C | sing | 1.09Å | 1.10Å | |
| C9 | H92C | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H313 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O23 | C21 | N22 | 122.8° | 120.0° |
| O23 | C21 | C20 | 123.2° | 120.0° |
| N22 | C21 | C20 | 114.0° | 120.0° |
| C21 | N22 | C32 | 131.1° | 120.0° |
| C21 | N22 | H22 | 114.4° | 119.9° |
| C21 | C20 | C16 | 129.4° | 126.5° |
| C21 | C20 | N19 | 122.7° | 126.5° |
| N22 | C32 | C33 | 103.9° | 109.5° |
| C32 | N22 | H22 | 114.5° | 120.0° |
| N22 | C32 | H321 | 111.4° | 109.5° |
| N22 | C32 | H322 | 112.6° | 109.5° |
| C32 | C33 | C38 | 121.1° | 120.8° |
| C32 | C33 | C34 | 119.9° | 120.7° |
| C33 | C32 | H321 | 111.4° | 109.5° |
| C33 | C32 | H322 | 112.6° | 109.5° |
| C38 | C33 | C34 | 119.1° | 118.4° |
| C33 | C38 | C37 | 118.8° | 119.2° |
| C33 | C38 | H38 | 120.6° | 120.4° |
| C33 | C34 | C35 | 120.5° | 119.2° |
| C33 | C34 | H34 | 119.8° | 120.5° |
| C38 | C37 | N36 | 120.7° | 120.8° |
| C37 | C38 | H38 | 120.6° | 120.5° |
| C38 | C37 | H37 | 119.7° | 119.6° |
| C37 | N36 | C35 | 122.3° | 121.7° |
| N36 | C37 | H37 | 119.7° | 119.6° |
| N36 | C35 | C39 | 120.3° | 119.6° |
| N36 | C35 | C34 | 118.7° | 120.7° |
| C39 | C35 | C34 | 120.9° | 119.7° |
| C35 | C39 | H391 | 109.5° | 109.5° |
| C35 | C39 | H392 | 109.5° | 109.5° |
| C35 | C39 | H393 | 109.4° | 109.5° |
| C35 | C34 | H34 | 119.7° | 120.4° |
| C16 | C20 | N19 | 107.8° | 107.1° |
| C20 | C16 | C8 | 132.6° | 131.8° |
| C20 | C16 | C17 | 107.0° | 105.7° |
| C20 | N19 | N18 | 108.5° | 110.6° |
| C8 | C16 | C17 | 120.4° | 122.5° |
| C16 | C8 | C9 | 109.9° | 109.7° |
| C16 | C8 | H81C | 109.3° | 109.4° |
| C16 | C8 | H82C | 109.2° | 109.4° |
| C16 | C17 | N18 | 107.7° | 107.0° |
| C16 | C17 | C10 | 121.2° | 120.4° |
| C8 | C9 | C11 | 110.7° | 112.5° |
| C9 | C8 | H81C | 109.3° | 109.4° |
| C9 | C8 | H82C | 109.2° | 109.5° |
| C8 | C9 | H91C | 109.0° | 108.9° |
| C8 | C9 | H92C | 108.8° | 108.9° |
| N19 | N18 | C24 | 114.8° | 125.2° |
| N19 | N18 | C17 | 108.9° | 109.6° |
| C24 | N18 | C17 | 136.2° | 125.2° |
| N18 | C24 | H241 | 109.5° | 109.4° |
| N18 | C24 | H242 | 109.5° | 109.5° |
| N18 | C24 | H243 | 109.5° | 109.5° |
| N18 | C17 | C10 | 130.8° | 132.6° |
| C17 | C10 | N15 | 120.6° | 123.0° |
| C17 | C10 | C11 | 118.9° | 117.1° |
| N15 | C10 | C11 | 120.2° | 119.9° |
| C10 | N15 | C14 | 121.6° | 120.1° |
| C10 | C11 | C12 | 117.6° | 117.9° |
| C10 | C11 | C9 | 121.0° | 121.4° |
| N15 | C14 | N13 | 118.2° | 121.5° |
| N15 | C14 | N1 | 122.2° | 119.2° |
| N13 | C14 | N1 | 119.6° | 119.2° |
| C14 | N13 | C12 | 123.1° | 121.4° |
| C14 | N1 | C2 | 127.5° | 120.0° |
| C14 | N1 | H1 | 116.3° | 119.9° |
| N13 | C12 | C11 | 119.3° | 119.1° |
| N13 | C12 | H12 | 120.4° | 120.4° |
| C12 | C11 | C9 | 121.4° | 120.7° |
| C11 | C12 | H12 | 120.3° | 120.5° |
| C11 | C9 | H91C | 109.1° | 108.9° |
| C11 | C9 | H92C | 108.7° | 108.8° |
| N1 | C2 | C7 | 119.2° | 120.0° |
| N1 | C2 | C3 | 120.6° | 120.0° |
| C2 | N1 | H1 | 116.2° | 120.1° |
| C7 | C2 | C3 | 120.1° | 120.0° |
| C2 | C7 | C6 | 120.0° | 120.0° |
| C2 | C7 | H7 | 120.0° | 120.0° |
| C2 | C3 | C4 | 120.3° | 120.0° |
| C2 | C3 | H3 | 119.8° | 120.0° |
| C7 | C6 | C5 | 119.4° | 120.0° |
| C6 | C7 | H7 | 120.0° | 120.0° |
| C7 | C6 | H6 | 120.3° | 120.0° |
| C6 | C5 | C4 | 119.4° | 120.0° |
| C6 | C5 | N25 | 121.8° | 120.0° |
| C5 | C6 | H6 | 120.3° | 120.0° |
| C4 | C5 | N25 | 118.7° | 120.0° |
| C5 | C4 | C3 | 120.7° | 120.0° |
| C5 | C4 | H4 | 119.6° | 120.0° |
| C5 | N25 | C30 | 119.5° | 111.0° |
| C5 | N25 | C26 | 118.8° | 111.0° |
| C4 | C3 | H3 | 119.9° | 120.0° |
| C3 | C4 | H4 | 119.6° | 120.0° |
| C30 | N25 | C26 | 121.6° | 110.9° |
| N25 | C30 | C29 | 104.5° | 109.3° |
| N25 | C30 | H301 | 111.1° | 109.5° |
| N25 | C30 | H302 | 112.2° | 109.5° |
| N25 | C26 | C27 | 110.2° | 109.3° |
| N25 | C26 | H261 | 109.3° | 109.5° |
| N25 | C26 | H262 | 109.1° | 109.4° |
| C30 | C29 | N28 | 101.0° | 109.4° |
| C29 | C30 | H301 | 111.2° | 109.5° |
| C29 | C30 | H302 | 112.2° | 109.5° |
| C30 | C29 | H291 | 112.4° | 109.4° |
| C30 | C29 | H292 | 114.2° | 109.5° |
| C29 | N28 | C31 | 114.9° | 111.0° |
| C29 | N28 | C27 | 107.2° | 110.9° |
| N28 | C29 | H291 | 112.4° | 109.5° |
| N28 | C29 | H292 | 114.2° | 109.5° |
| C31 | N28 | C27 | 114.4° | 111.0° |
| N28 | C31 | H311 | 109.5° | 109.5° |
| N28 | C31 | H312 | 109.5° | 109.5° |
| N28 | C31 | H313 | 109.4° | 109.4° |
| N28 | C27 | C26 | 109.8° | 109.4° |
| N28 | C27 | H271 | 109.4° | 109.5° |
| N28 | C27 | H272 | 109.3° | 109.5° |
| C27 | C26 | H261 | 109.2° | 109.6° |
| C27 | C26 | H262 | 109.1° | 109.5° |
| C26 | C27 | H271 | 109.3° | 109.5° |
| C26 | C27 | H272 | 109.3° | 109.4° |
| H321 | C32 | H322 | 105.2° | 109.4° |
| H391 | C39 | H392 | 109.5° | 109.4° |
| H391 | C39 | H393 | 109.5° | 109.4° |
| H392 | C39 | H393 | 109.5° | 109.5° |
| H81C | C8 | H82C | 109.8° | 109.4° |
| H91C | C9 | H92C | 110.5° | 108.8° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H241 | C24 | H243 | 109.5° | 109.4° |
| H242 | C24 | H243 | 109.4° | 109.5° |
| H301 | C30 | H302 | 105.7° | 109.5° |
| H261 | C26 | H262 | 110.0° | 109.5° |
| H291 | C29 | H292 | 103.1° | 109.6° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| H311 | C31 | H313 | 109.4° | 109.5° |
| H312 | C31 | H313 | 109.5° | 109.5° |
| H271 | C27 | H272 | 109.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O23 | C21 | N22 | C20 | 178.4° | 179.9° |
| O23 | C21 | N22 | C32 | 4.7° | 0.1° |
| O23 | C21 | C20 | C16 | 24.0° | 0.1° |
| O23 | C21 | C20 | N19 | 157.3° | 179.6° |
| O23 | C21 | N22 | H22 | 175.3° | 180.0° |
| C21 | N22 | C32 | H22 | 180.0° | 179.9° |
| C21 | N22 | C32 | C33 | 85.9° | 180.0° |
| N22 | C21 | C20 | C16 | 154.4° | 179.8° |
| N22 | C21 | C20 | N19 | 24.2° | 0.5° |
| C21 | N22 | C32 | H321 | 154.1° | 60.1° |
| C21 | N22 | C32 | H322 | 36.1° | 59.9° |
| C20 | C21 | N22 | C32 | 176.8° | 179.7° |
| C21 | C20 | C16 | N19 | 178.8° | 179.8° |
| C21 | C20 | C16 | C8 | 0.3° | 1.0° |
| C21 | C20 | C16 | C17 | 179.4° | 179.6° |
| C21 | C20 | N19 | N18 | 179.4° | 180.0° |
| C20 | C21 | N22 | H22 | 3.2° | 0.1° |
| N22 | C32 | C33 | H321 | 120.0° | 120.0° |
| N22 | C32 | C33 | H322 | 122.1° | 120.0° |
| N22 | C32 | C33 | C38 | 164.3° | 90.0° |
| N22 | C32 | C33 | C34 | 16.6° | 90.3° |
| N22 | C32 | H321 | H322 | 122.3° | 120.0° |
| C32 | C33 | C38 | C34 | 179.1° | 179.7° |
| C32 | C33 | C38 | C37 | 179.8° | 180.0° |
| C32 | C33 | C34 | C35 | 179.3° | 179.8° |
| C33 | C32 | N22 | H22 | 94.1° | 0.1° |
| C33 | C32 | H321 | H322 | 122.3° | 120.0° |
| C32 | C33 | C38 | H38 | 0.2° | 0.0° |
| C32 | C33 | C34 | H34 | 0.7° | 0.0° |
| C33 | C38 | C37 | H38 | 180.0° | 180.0° |
| C33 | C38 | C37 | N36 | 0.6° | 0.0° |
| C38 | C33 | C34 | C35 | 0.2° | 0.5° |
| C38 | C33 | C32 | H321 | 75.7° | 30.0° |
| C38 | C33 | C32 | H322 | 42.3° | 150.0° |
| C38 | C33 | C34 | H34 | 179.8° | 179.8° |
| C33 | C38 | C37 | H37 | 179.4° | 179.9° |
| C34 | C33 | C38 | C37 | 1.1° | 0.2° |
| C33 | C34 | C35 | N36 | 1.2° | 0.5° |
| C33 | C34 | C35 | C39 | 179.1° | 179.7° |
| C33 | C34 | C35 | H34 | 180.0° | 179.7° |
| C34 | C33 | C32 | H321 | 103.4° | 149.7° |
| C34 | C33 | C32 | H322 | 138.6° | 29.7° |
| C34 | C33 | C38 | H38 | 178.9° | 179.8° |
| C38 | C37 | N36 | H37 | 180.0° | 179.9° |
| C38 | C37 | N36 | C35 | 0.9° | 0.0° |
| C37 | N36 | C35 | C39 | 179.7° | 180.0° |
| C37 | N36 | C35 | C34 | 1.8° | 0.2° |
| N36 | C37 | C38 | H38 | 179.4° | 180.0° |
| N36 | C35 | C39 | C34 | 177.9° | 179.8° |
| N36 | C35 | C34 | H34 | 178.8° | 179.8° |
| C35 | N36 | C37 | H37 | 179.1° | 180.0° |
| N36 | C35 | C39 | H391 | 148.2° | 90.0° |
| N36 | C35 | C39 | H392 | 91.8° | 150.1° |
| N36 | C35 | C39 | H393 | 28.2° | 30.0° |
| C39 | C35 | C34 | H34 | 0.9° | 0.0° |
| C35 | C39 | H391 | H392 | 120.0° | 120.0° |
| C35 | C39 | H391 | H393 | 120.0° | 120.1° |
| C35 | C39 | H392 | H393 | 120.0° | 120.1° |
| C34 | C35 | C39 | H391 | 29.6° | 89.7° |
| C34 | C35 | C39 | H392 | 90.3° | 30.2° |
| C34 | C35 | C39 | H393 | 149.7° | 150.3° |
| C20 | C16 | C8 | C17 | 178.9° | 179.3° |
| C20 | C16 | C8 | C9 | 150.3° | 149.1° |
| C16 | C20 | N19 | N18 | 0.5° | 0.3° |
| C20 | C16 | C17 | N18 | 2.6° | 0.5° |
| C20 | C16 | C17 | C10 | 177.2° | 178.7° |
| C20 | C16 | C8 | H81C | 30.3° | 90.8° |
| C20 | C16 | C8 | H82C | 90.0° | 29.0° |
| N19 | C20 | C16 | C8 | 179.1° | 179.2° |
| N19 | C20 | C16 | C17 | 1.8° | 0.1° |
| C20 | N19 | N18 | C24 | 178.6° | 179.6° |
| C20 | N19 | N18 | C17 | 1.2° | 0.6° |
| C16 | C8 | C9 | H81C | 120.0° | 120.1° |
| C16 | C8 | C9 | H82C | 119.8° | 120.1° |
| C8 | C16 | C17 | N18 | 178.3° | 179.0° |
| C8 | C16 | C17 | C10 | 3.6° | 1.9° |
| C16 | C8 | C9 | C11 | 46.3° | 45.4° |
| C16 | C8 | H81C | H82C | 119.8° | 119.8° |
| C16 | C8 | C9 | H91C | 73.7° | 166.2° |
| C16 | C8 | C9 | H92C | 165.7° | 75.3° |
| C17 | C16 | C8 | C9 | 28.7° | 31.6° |
| C16 | C17 | N18 | N19 | 2.3° | 0.6° |
| C16 | C17 | N18 | C24 | 178.9° | 179.6° |
| C16 | C17 | N18 | C10 | 173.9° | 179.0° |
| C16 | C17 | C10 | N15 | 157.3° | 167.6° |
| C16 | C17 | C10 | C11 | 16.8° | 13.4° |
| C17 | C16 | C8 | H81C | 148.7° | 88.5° |
| C17 | C16 | C8 | H82C | 91.1° | 151.7° |
| C8 | C9 | C11 | C10 | 37.8° | 34.5° |
| C8 | C9 | C11 | C12 | 144.4° | 147.6° |
| C8 | C9 | C11 | H91C | 120.0° | 120.9° |
| C8 | C9 | C11 | H92C | 119.5° | 120.7° |
| C9 | C8 | H81C | H82C | 119.8° | 119.9° |
| C8 | C9 | H91C | H92C | 119.5° | 118.5° |
| N19 | N18 | C24 | C17 | 176.4° | 179.8° |
| N19 | N18 | C17 | C10 | 176.2° | 178.4° |
| N19 | N18 | C24 | H241 | 90.0° | 90.0° |
| N19 | N18 | C24 | H242 | 150.0° | 149.9° |
| N19 | N18 | C24 | H243 | 30.1° | 29.9° |
| C24 | N18 | C17 | C10 | 7.2° | 1.4° |
| N18 | C24 | H241 | H242 | 120.0° | 120.1° |
| N18 | C24 | H241 | H243 | 120.0° | 120.0° |
| N18 | C24 | H242 | H243 | 120.0° | 120.0° |
| N18 | C17 | C10 | N15 | 16.0° | 13.5° |
| N18 | C17 | C10 | C11 | 170.0° | 165.5° |
| C17 | N18 | C24 | H241 | 86.5° | 90.2° |
| C17 | N18 | C24 | H242 | 33.5° | 29.8° |
| C17 | N18 | C24 | H243 | 153.5° | 149.9° |
| C17 | C10 | N15 | C11 | 174.0° | 178.9° |
| C17 | C10 | N15 | C14 | 176.5° | 178.7° |
| C17 | C10 | C11 | C12 | 176.7° | 178.0° |
| C17 | C10 | C11 | C9 | 5.5° | 4.1° |
| C10 | N15 | C14 | N13 | 1.6° | 0.4° |
| C10 | N15 | C14 | N1 | 179.3° | 179.6° |
| N15 | C10 | C11 | C12 | 2.6° | 3.0° |
| N15 | C10 | C11 | C9 | 179.6° | 174.9° |
| C11 | C10 | N15 | C14 | 2.5° | 2.4° |
| C10 | C11 | C12 | N13 | 1.9° | 1.7° |
| C10 | C11 | C12 | C9 | 177.8° | 177.9° |
| C10 | C11 | C9 | H91C | 82.2° | 155.3° |
| C10 | C11 | C9 | H92C | 157.3° | 86.2° |
| C10 | C11 | C12 | H12 | 178.1° | 178.3° |
| N15 | C14 | N13 | N1 | 177.8° | 180.0° |
| N15 | C14 | N13 | C12 | 0.8° | 1.0° |
| N15 | C14 | N1 | C2 | 9.9° | 174.5° |
| N15 | C14 | N1 | H1 | 170.1° | 5.5° |
| C14 | N13 | C12 | C11 | 1.1° | 0.3° |
| N13 | C14 | N1 | C2 | 172.4° | 5.5° |
| N13 | C14 | N1 | H1 | 7.6° | 174.5° |
| C14 | N13 | C12 | H12 | 179.0° | 179.7° |
| N1 | C14 | N13 | C12 | 178.7° | 179.0° |
| C14 | N1 | C2 | H1 | 180.0° | 180.0° |
| C14 | N1 | C2 | C7 | 146.2° | 146.5° |
| C14 | N1 | C2 | C3 | 34.3° | 33.7° |
| N13 | C12 | C11 | H12 | 180.0° | 180.0° |
| N13 | C12 | C11 | C9 | 179.7° | 176.3° |
| C12 | C11 | C9 | H91C | 95.6° | 26.8° |
| C12 | C11 | C9 | H92C | 24.9° | 91.6° |
| C11 | C9 | C8 | H81C | 166.3° | 74.7° |
| C11 | C9 | C8 | H82C | 73.5° | 165.4° |
| C11 | C9 | H91C | H92C | 119.5° | 118.4° |
| C9 | C11 | C12 | H12 | 0.3° | 3.7° |
| N1 | C2 | C7 | C3 | 179.5° | 179.8° |
| N1 | C2 | C7 | C6 | 178.8° | 180.0° |
| N1 | C2 | C3 | C4 | 179.5° | 179.8° |
| N1 | C2 | C7 | H7 | 1.2° | 0.0° |
| N1 | C2 | C3 | H3 | 0.6° | 0.1° |
| C2 | C7 | C6 | H7 | 180.0° | 180.0° |
| C2 | C7 | C6 | C5 | 0.7° | 0.0° |
| C7 | C2 | C3 | C4 | 1.1° | 0.5° |
| C7 | C2 | N1 | H1 | 33.8° | 33.5° |
| C7 | C2 | C3 | H3 | 178.9° | 179.7° |
| C2 | C7 | C6 | H6 | 179.3° | 179.9° |
| C3 | C2 | C7 | C6 | 1.7° | 0.3° |
| C2 | C3 | C4 | C5 | 0.5° | 0.4° |
| C2 | C3 | C4 | H3 | 180.0° | 179.8° |
| C3 | C2 | N1 | H1 | 145.7° | 146.3° |
| C3 | C2 | C7 | H7 | 178.3° | 179.8° |
| C2 | C3 | C4 | H4 | 179.5° | 179.8° |
| C7 | C6 | C5 | H6 | 180.0° | 179.9° |
| C7 | C6 | C5 | C4 | 0.8° | 0.0° |
| C7 | C6 | C5 | N25 | 177.7° | 180.0° |
| C6 | C5 | C4 | N25 | 177.0° | 180.0° |
| C6 | C5 | C4 | C3 | 1.4° | 0.2° |
| C6 | C5 | N25 | C30 | 6.0° | 180.0° |
| C6 | C5 | N25 | C26 | 172.1° | 56.3° |
| C5 | C6 | C7 | H7 | 179.3° | 180.0° |
| C6 | C5 | C4 | H4 | 178.6° | 180.0° |
| C5 | C4 | C3 | H4 | 180.0° | 179.8° |
| C4 | C5 | N25 | C30 | 177.1° | 0.0° |
| C4 | C5 | N25 | C26 | 4.8° | 123.8° |
| C5 | C4 | C3 | H3 | 179.5° | 179.7° |
| C4 | C5 | C6 | H6 | 179.2° | 180.0° |
| N25 | C5 | C4 | C3 | 178.4° | 179.8° |
| C5 | N25 | C30 | C26 | 178.0° | 123.8° |
| C5 | N25 | C30 | C29 | 130.5° | 176.8° |
| C5 | N25 | C26 | C27 | 146.1° | 176.8° |
| N25 | C5 | C6 | H6 | 2.3° | 0.0° |
| N25 | C5 | C4 | H4 | 1.6° | 0.0° |
| C5 | N25 | C30 | H301 | 10.5° | 56.8° |
| C5 | N25 | C30 | H302 | 107.6° | 63.2° |
| C5 | N25 | C26 | H261 | 93.8° | 63.1° |
| C5 | N25 | C26 | H262 | 26.4° | 56.9° |
| N25 | C30 | C29 | H301 | 120.0° | 120.0° |
| N25 | C30 | C29 | H302 | 121.9° | 119.9° |
| N25 | C30 | C29 | N28 | 68.7° | 58.3° |
| C30 | N25 | C26 | C27 | 35.8° | 59.4° |
| N25 | C30 | H301 | H302 | 122.0° | 120.0° |
| C30 | N25 | C26 | H261 | 84.2° | 60.7° |
| C30 | N25 | C26 | H262 | 155.5° | 179.3° |
| N25 | C30 | C29 | H291 | 51.3° | 61.6° |
| N25 | C30 | C29 | H292 | 168.4° | 178.3° |
| C26 | N25 | C30 | C29 | 51.4° | 59.3° |
| N25 | C26 | C27 | N28 | 39.1° | 58.5° |
| N25 | C26 | C27 | H261 | 120.0° | 120.0° |
| N25 | C26 | C27 | H262 | 119.7° | 119.9° |
| C26 | N25 | C30 | H301 | 171.5° | 179.3° |
| C26 | N25 | C30 | H302 | 70.4° | 60.6° |
| N25 | C26 | H261 | H262 | 119.7° | 120.0° |
| N25 | C26 | C27 | H271 | 80.9° | 61.5° |
| N25 | C26 | C27 | H272 | 158.9° | 178.4° |
| C30 | C29 | N28 | H291 | 120.0° | 119.9° |
| C30 | C29 | N28 | H292 | 123.0° | 120.0° |
| C30 | C29 | N28 | C31 | 151.2° | 176.8° |
| C30 | C29 | N28 | C27 | 80.4° | 59.3° |
| C29 | C30 | H301 | H302 | 122.0° | 120.1° |
| C30 | C29 | H291 | H292 | 123.5° | 120.0° |
| C29 | N28 | C31 | C27 | 124.7° | 123.9° |
| C29 | N28 | C27 | C26 | 65.1° | 59.3° |
| N28 | C29 | C30 | H301 | 171.3° | 178.3° |
| N28 | C29 | C30 | H302 | 53.2° | 61.6° |
| N28 | C29 | H291 | H292 | 123.4° | 120.1° |
| C29 | N28 | C31 | H311 | 36.2° | 59.9° |
| C29 | N28 | C31 | H312 | 83.9° | 180.0° |
| C29 | N28 | C31 | H313 | 156.1° | 60.1° |
| C29 | N28 | C27 | H271 | 54.9° | 60.7° |
| C29 | N28 | C27 | H272 | 175.1° | 179.2° |
| C31 | N28 | C27 | C26 | 166.3° | 176.7° |
| C31 | N28 | C29 | H291 | 88.8° | 63.3° |
| C31 | N28 | C29 | H292 | 28.2° | 56.8° |
| N28 | C31 | H311 | H312 | 120.0° | 120.0° |
| N28 | C31 | H311 | H313 | 120.0° | 119.9° |
| N28 | C31 | H312 | H313 | 120.0° | 120.0° |
| C31 | N28 | C27 | H271 | 73.8° | 63.2° |
| C31 | N28 | C27 | H272 | 46.4° | 56.8° |
| N28 | C27 | C26 | H271 | 120.0° | 120.0° |
| N28 | C27 | C26 | H272 | 119.9° | 119.9° |
| N28 | C27 | C26 | H261 | 81.0° | 61.6° |
| N28 | C27 | C26 | H262 | 158.8° | 178.3° |
| C27 | N28 | C29 | H291 | 39.6° | 60.6° |
| C27 | N28 | C29 | H292 | 156.6° | 179.2° |
| C27 | N28 | C31 | H311 | 88.5° | 176.2° |
| C27 | N28 | C31 | H312 | 151.4° | 56.2° |
| C27 | N28 | C31 | H313 | 31.4° | 63.8° |
| N28 | C27 | H271 | H272 | 119.9° | 120.0° |
| C27 | C26 | H261 | H262 | 119.7° | 120.1° |
| C26 | C27 | H271 | H272 | 119.9° | 120.0° |
| H22 | N22 | C32 | H321 | 25.9° | 120.1° |
| H22 | N22 | C32 | H322 | 143.9° | 120.0° |
| H38 | C38 | C37 | H37 | 0.6° | 0.0° |
| H391 | C39 | H392 | H393 | 120.0° | 119.9° |
| H81C | C8 | C9 | H91C | 46.2° | 46.1° |
| H81C | C8 | C9 | H92C | 74.3° | 164.6° |
| H82C | C8 | C9 | H91C | 166.4° | 73.7° |
| H82C | C8 | C9 | H92C | 45.9° | 44.7° |
| H241 | C24 | H242 | H243 | 120.0° | 120.0° |
| H7 | C7 | C6 | H6 | 0.8° | 0.0° |
| H3 | C3 | C4 | H4 | 0.4° | 0.1° |
| H301 | C30 | C29 | H291 | 68.7° | 58.4° |
| H301 | C30 | C29 | H292 | 48.4° | 61.7° |
| H302 | C30 | C29 | H291 | 173.2° | 178.5° |
| H302 | C30 | C29 | H292 | 69.8° | 58.4° |
| H261 | C26 | C27 | H271 | 159.0° | 178.4° |
| H261 | C26 | C27 | H272 | 38.9° | 58.4° |
| H262 | C26 | C27 | H271 | 38.8° | 58.3° |
| H262 | C26 | C27 | H272 | 81.4° | 61.8° |
| H311 | C31 | H312 | H313 | 120.0° | 120.0° |
