Q68
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O17 | C3 | sing | 1.43Å | 1.41Å | |
| O29 | C27 | doub | 1.21Å | 1.23Å | |
| O18 | C4 | sing | 1.43Å | 1.43Å | |
| C28 | C27 | sing | 1.51Å | 1.50Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C27 | N26 | sing | 1.35Å | 1.33Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| N7 | C8 | sing | 1.47Å | 1.47Å | |
| N7 | C1 | sing | 1.47Å | 1.49Å | |
| N26 | C25 | sing | 1.46Å | 1.46Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C5 | O19 | sing | 1.43Å | 1.45Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C25 | C23 | sing | 1.51Å | 1.52Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C23 | C22 | doub | 1.35Å | 1.39Å | Aromatic |
| C23 | N24 | sing | 1.34Å | 1.36Å | Aromatic |
| C22 | N20 | sing | 1.35Å | 1.34Å | Aromatic |
| C6 | C16 | sing | 1.53Å | 1.51Å | |
| N24 | N21 | doub | 1.29Å | 1.40Å | Aromatic |
| N20 | N21 | sing | 1.29Å | 1.40Å | Aromatic |
| N20 | C16 | sing | 1.46Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| N7 | HN7 | sing | 1.01Å | 1.00Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| O17 | HO17 | sing | 0.97Å | 0.95Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| O19 | HO19 | sing | 0.97Å | 0.95Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| N26 | HN26 | sing | 0.97Å | 1.00Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O17 | C3 | C4 | 112.9° | 109.5° |
| O17 | C3 | C2 | 108.4° | 109.5° |
| O17 | C3 | H3 | 108.7° | 109.4° |
| C3 | O17 | HO17 | 109.5° | 114.0° |
| O29 | C27 | C28 | 122.3° | 120.0° |
| O29 | C27 | N26 | 122.0° | 120.0° |
| O18 | C4 | C3 | 111.6° | 109.5° |
| O18 | C4 | C5 | 108.4° | 109.4° |
| O18 | C4 | H4 | 109.8° | 109.5° |
| C4 | O18 | HO18 | 109.5° | 114.0° |
| C28 | C27 | N26 | 115.7° | 120.0° |
| C27 | C28 | H28 | 109.5° | 109.4° |
| C27 | C28 | H281 | 109.4° | 109.5° |
| C27 | C28 | H282 | 109.4° | 109.5° |
| C13 | C12 | C11 | 112.0° | 109.4° |
| C13 | C12 | H121 | 108.8° | 109.5° |
| C13 | C12 | H12 | 108.8° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C12 | C13 | H131 | 109.5° | 109.5° |
| C12 | C13 | H14 | 109.4° | 109.4° |
| C27 | N26 | C25 | 121.3° | 120.0° |
| C27 | N26 | HN26 | 119.4° | 120.0° |
| C4 | C3 | C2 | 112.4° | 109.5° |
| C3 | C4 | C5 | 111.0° | 109.5° |
| C4 | C3 | H3 | 107.0° | 109.5° |
| C3 | C4 | H4 | 108.1° | 109.5° |
| C3 | C2 | C1 | 104.4° | 109.5° |
| C3 | C2 | H2 | 110.7° | 109.5° |
| C3 | C2 | H21 | 110.7° | 109.5° |
| C2 | C3 | H3 | 107.2° | 109.5° |
| C12 | C11 | C10 | 112.4° | 109.5° |
| C12 | C11 | H111 | 108.7° | 109.5° |
| C12 | C11 | H11 | 108.8° | 109.5° |
| C11 | C12 | H121 | 108.9° | 109.4° |
| C11 | C12 | H12 | 108.8° | 109.5° |
| C11 | C10 | C9 | 112.6° | 109.5° |
| C11 | C10 | H101 | 108.7° | 109.5° |
| C11 | C10 | H10 | 108.7° | 109.5° |
| C10 | C11 | H111 | 108.7° | 109.4° |
| C10 | C11 | H11 | 108.7° | 109.5° |
| C10 | C9 | C8 | 109.2° | 109.5° |
| C10 | C9 | H91 | 109.5° | 109.5° |
| C10 | C9 | H9 | 109.5° | 109.5° |
| C9 | C10 | H101 | 108.7° | 109.4° |
| C9 | C10 | H10 | 108.7° | 109.5° |
| C9 | C8 | N7 | 115.1° | 109.5° |
| C9 | C8 | H81 | 108.0° | 109.5° |
| C9 | C8 | H8 | 108.1° | 109.5° |
| C8 | C9 | H91 | 109.5° | 109.5° |
| C8 | C9 | H9 | 109.5° | 109.5° |
| C4 | C5 | O19 | 115.7° | 109.5° |
| C4 | C5 | C6 | 108.5° | 109.5° |
| C5 | C4 | H4 | 108.0° | 109.5° |
| C4 | C5 | H5 | 107.1° | 109.5° |
| C8 | N7 | C1 | 113.4° | 111.0° |
| C8 | N7 | HN7 | 108.5° | 111.0° |
| N7 | C8 | H81 | 108.1° | 109.5° |
| N7 | C8 | H8 | 108.0° | 109.5° |
| N7 | C1 | C2 | 110.4° | 109.5° |
| N7 | C1 | C6 | 118.3° | 109.5° |
| N7 | C1 | H1 | 107.2° | 109.5° |
| C1 | N7 | HN7 | 108.5° | 111.0° |
| N26 | C25 | C23 | 112.4° | 109.4° |
| N26 | C25 | H251 | 108.7° | 109.5° |
| N26 | C25 | H25 | 108.7° | 109.5° |
| C25 | N26 | HN26 | 119.3° | 120.0° |
| C2 | C1 | C6 | 107.2° | 109.4° |
| C2 | C1 | H1 | 106.7° | 109.5° |
| C1 | C2 | H2 | 110.7° | 109.5° |
| C1 | C2 | H21 | 110.7° | 109.5° |
| O19 | C5 | C6 | 109.0° | 109.5° |
| O19 | C5 | H5 | 108.5° | 109.5° |
| C5 | O19 | HO19 | 109.5° | 114.0° |
| C5 | C6 | C1 | 111.7° | 109.5° |
| C5 | C6 | C16 | 113.8° | 109.5° |
| C6 | C5 | H5 | 107.6° | 109.4° |
| C5 | C6 | H6 | 106.0° | 109.4° |
| C25 | C23 | C22 | 127.9° | 126.7° |
| C25 | C23 | N24 | 124.1° | 126.8° |
| C23 | C25 | H251 | 108.7° | 109.4° |
| C23 | C25 | H25 | 108.7° | 109.5° |
| C1 | C6 | C16 | 112.7° | 109.5° |
| C6 | C1 | H1 | 106.5° | 109.5° |
| C1 | C6 | H6 | 105.7° | 109.5° |
| C22 | C23 | N24 | 108.0° | 106.5° |
| C23 | C22 | N20 | 106.9° | 106.2° |
| C23 | C22 | H22 | 126.5° | 126.9° |
| C23 | N24 | N21 | 109.9° | 108.8° |
| C22 | N20 | N21 | 111.4° | 108.3° |
| C22 | N20 | C16 | 135.1° | 125.9° |
| N20 | C22 | H22 | 126.6° | 126.9° |
| C6 | C16 | N20 | 117.0° | 109.5° |
| C16 | C6 | H6 | 106.1° | 109.4° |
| C6 | C16 | H16 | 107.5° | 109.4° |
| C6 | C16 | H161 | 107.5° | 109.5° |
| N24 | N21 | N20 | 103.8° | 110.2° |
| N21 | N20 | C16 | 113.4° | 125.9° |
| N20 | C16 | H16 | 107.6° | 109.5° |
| N20 | C16 | H161 | 107.6° | 109.5° |
| H2 | C2 | H21 | 109.4° | 109.5° |
| H81 | C8 | H8 | 109.4° | 109.4° |
| H91 | C9 | H9 | 109.5° | 109.4° |
| H101 | C10 | H10 | 109.4° | 109.5° |
| H111 | C11 | H11 | 109.4° | 109.5° |
| H121 | C12 | H12 | 109.5° | 109.5° |
| H13 | C13 | H131 | 109.4° | 109.5° |
| H13 | C13 | H14 | 109.5° | 109.5° |
| H131 | C13 | H14 | 109.5° | 109.5° |
| H16 | C16 | H161 | 109.4° | 109.5° |
| H251 | C25 | H25 | 109.5° | 109.5° |
| H28 | C28 | H281 | 109.5° | 109.5° |
| H28 | C28 | H282 | 109.5° | 109.4° |
| H281 | C28 | H282 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O17 | C3 | C4 | O18 | 60.3° | 60.0° |
| O17 | C3 | C4 | C2 | 123.1° | 120.0° |
| O17 | C3 | C4 | H3 | 119.6° | 119.9° |
| O17 | C3 | C2 | H3 | 117.2° | 119.9° |
| O17 | C3 | C4 | C5 | 178.7° | 179.9° |
| O17 | C3 | C2 | C1 | 171.3° | 180.0° |
| O17 | C3 | C2 | H2 | 52.1° | 60.0° |
| O17 | C3 | C2 | H21 | 69.4° | 60.0° |
| O17 | C3 | C4 | H4 | 60.5° | 60.0° |
| O29 | C27 | C28 | N26 | 179.7° | 180.0° |
| O29 | C27 | N26 | C25 | 0.8° | 0.0° |
| O29 | C27 | N26 | HN26 | 179.2° | 180.0° |
| O29 | C27 | C28 | H28 | 0.0° | 180.0° |
| O29 | C27 | C28 | H281 | 120.0° | 60.0° |
| O29 | C27 | C28 | H282 | 120.0° | 60.1° |
| O18 | C4 | C3 | C5 | 121.0° | 120.0° |
| O18 | C4 | C3 | H4 | 120.8° | 120.0° |
| O18 | C4 | C3 | C2 | 176.6° | 180.0° |
| O18 | C4 | C5 | H4 | 118.9° | 120.0° |
| O18 | C4 | C5 | O19 | 64.3° | 60.0° |
| O18 | C4 | C5 | C6 | 172.8° | 180.0° |
| O18 | C4 | C3 | H3 | 59.2° | 60.0° |
| O18 | C4 | C5 | H5 | 56.9° | 60.0° |
| C28 | C27 | N26 | C25 | 178.9° | 180.0° |
| C28 | C27 | N26 | HN26 | 1.1° | 0.0° |
| C27 | C28 | H28 | H281 | 120.0° | 120.0° |
| C27 | C28 | H28 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H282 | 119.9° | 120.0° |
| C13 | C12 | C11 | H121 | 120.4° | 120.0° |
| C13 | C12 | C11 | H12 | 120.4° | 120.0° |
| C13 | C12 | C11 | C10 | 177.7° | 180.0° |
| C13 | C12 | C11 | H111 | 57.3° | 60.0° |
| C13 | C12 | C11 | H11 | 61.9° | 60.0° |
| C13 | C12 | H121 | H12 | 118.8° | 120.1° |
| C12 | C13 | H13 | H131 | 120.0° | 120.0° |
| C12 | C13 | H13 | H14 | 120.0° | 119.9° |
| C12 | C13 | H131 | H14 | 120.0° | 119.9° |
| C27 | N26 | C25 | HN26 | 180.0° | 180.0° |
| C27 | N26 | C25 | C23 | 134.5° | 180.0° |
| C27 | N26 | C25 | H251 | 14.1° | 60.0° |
| C27 | N26 | C25 | H25 | 105.0° | 60.0° |
| N26 | C27 | C28 | H28 | 179.7° | 0.0° |
| N26 | C27 | C28 | H281 | 60.3° | 120.0° |
| N26 | C27 | C28 | H282 | 59.7° | 119.9° |
| C4 | C3 | C2 | H3 | 117.2° | 120.1° |
| C3 | C4 | C5 | H4 | 118.3° | 120.0° |
| C4 | C3 | C2 | C1 | 63.1° | 60.0° |
| C3 | C4 | C5 | O19 | 172.8° | 180.0° |
| C3 | C4 | C5 | C6 | 49.9° | 60.0° |
| C4 | C3 | C2 | H2 | 177.7° | 60.0° |
| C4 | C3 | C2 | H21 | 56.1° | 180.0° |
| C3 | C4 | C5 | H5 | 66.0° | 60.0° |
| C4 | C3 | O17 | HO17 | 180.0° | 60.0° |
| C3 | C4 | O18 | HO18 | 180.0° | 59.9° |
| C2 | C3 | C4 | C5 | 55.6° | 60.0° |
| C3 | C2 | C1 | N7 | 63.3° | 60.0° |
| C3 | C2 | C1 | H2 | 119.2° | 120.0° |
| C3 | C2 | C1 | H21 | 119.2° | 120.0° |
| C3 | C2 | C1 | C6 | 66.7° | 60.0° |
| C3 | C2 | C1 | H1 | 179.5° | 180.0° |
| C3 | C2 | H2 | H21 | 122.3° | 120.0° |
| C2 | C3 | C4 | H4 | 62.6° | 60.0° |
| C2 | C3 | O17 | HO17 | 54.7° | 180.0° |
| C12 | C11 | C10 | H111 | 120.4° | 120.0° |
| C12 | C11 | C10 | H11 | 120.5° | 120.0° |
| C12 | C11 | C10 | C9 | 164.7° | 180.0° |
| C12 | C11 | C10 | H101 | 74.8° | 60.0° |
| C12 | C11 | C10 | H10 | 44.2° | 60.0° |
| C12 | C11 | H111 | H11 | 118.7° | 120.0° |
| C11 | C12 | H121 | H12 | 118.9° | 120.0° |
| C11 | C12 | C13 | H13 | 180.0° | 60.0° |
| C11 | C12 | C13 | H131 | 60.0° | 60.0° |
| C11 | C12 | C13 | H14 | 60.0° | 180.0° |
| C11 | C10 | C9 | H101 | 120.5° | 120.0° |
| C11 | C10 | C9 | H10 | 120.5° | 120.1° |
| C11 | C10 | C9 | C8 | 162.0° | 180.0° |
| C11 | C10 | C9 | H91 | 78.1° | 60.0° |
| C11 | C10 | C9 | H9 | 42.0° | 60.0° |
| C11 | C10 | H101 | H10 | 118.5° | 120.1° |
| C10 | C11 | H111 | H11 | 118.6° | 120.0° |
| C10 | C11 | C12 | H121 | 61.9° | 60.0° |
| C10 | C11 | C12 | H12 | 57.3° | 60.0° |
| C10 | C9 | C8 | H91 | 120.0° | 120.0° |
| C10 | C9 | C8 | H9 | 119.9° | 120.0° |
| C10 | C9 | C8 | N7 | 175.6° | 180.0° |
| C10 | C9 | C8 | H81 | 63.5° | 60.0° |
| C10 | C9 | C8 | H8 | 54.8° | 60.0° |
| C10 | C9 | H91 | H9 | 120.1° | 120.0° |
| C9 | C10 | H101 | H10 | 118.6° | 120.0° |
| C9 | C10 | C11 | H111 | 44.3° | 60.0° |
| C9 | C10 | C11 | H11 | 74.8° | 60.0° |
| C9 | C8 | N7 | H81 | 120.8° | 120.0° |
| C9 | C8 | N7 | H8 | 120.8° | 120.0° |
| C9 | C8 | N7 | C1 | 179.4° | 180.0° |
| C9 | C8 | N7 | HN7 | 60.0° | 56.0° |
| C9 | C8 | H81 | H8 | 117.5° | 120.0° |
| C8 | C9 | H91 | H9 | 120.1° | 120.0° |
| C8 | C9 | C10 | H101 | 41.5° | 60.0° |
| C8 | C9 | C10 | H10 | 77.6° | 60.0° |
| C4 | C5 | O19 | C6 | 122.6° | 120.0° |
| C4 | C5 | O19 | H5 | 120.4° | 120.1° |
| C4 | C5 | C6 | H5 | 115.6° | 120.0° |
| C4 | C5 | C6 | C1 | 57.1° | 60.0° |
| C4 | C5 | C6 | C16 | 173.8° | 180.0° |
| C5 | C4 | C3 | H3 | 61.7° | 60.0° |
| C4 | C5 | C6 | H6 | 57.6° | 60.0° |
| C5 | C4 | O18 | HO18 | 57.5° | 179.9° |
| C4 | C5 | O19 | HO19 | 180.0° | 60.0° |
| C8 | N7 | C1 | HN7 | 120.6° | 123.9° |
| C8 | N7 | C1 | C2 | 106.4° | 85.0° |
| C8 | N7 | C1 | C6 | 129.7° | 155.0° |
| C8 | N7 | C1 | H1 | 9.5° | 35.0° |
| N7 | C8 | H81 | H8 | 117.4° | 120.0° |
| N7 | C8 | C9 | H91 | 55.6° | 60.0° |
| N7 | C8 | C9 | H9 | 64.4° | 60.0° |
| N7 | C1 | C2 | C6 | 130.0° | 120.0° |
| N7 | C1 | C2 | H1 | 116.1° | 120.0° |
| N7 | C1 | C6 | C5 | 57.6° | 60.0° |
| N7 | C1 | C6 | H1 | 120.6° | 120.0° |
| N7 | C1 | C6 | C16 | 72.1° | 60.0° |
| N7 | C1 | C2 | H2 | 55.9° | 180.0° |
| N7 | C1 | C2 | H21 | 177.5° | 60.0° |
| N7 | C1 | C6 | H6 | 172.4° | 180.0° |
| C1 | N7 | C8 | H81 | 58.6° | 60.0° |
| C1 | N7 | C8 | H8 | 59.7° | 60.0° |
| N26 | C25 | C23 | H251 | 120.4° | 120.0° |
| N26 | C25 | C23 | H25 | 120.4° | 120.0° |
| N26 | C25 | C23 | C22 | 3.2° | 95.1° |
| N26 | C25 | C23 | N24 | 177.4° | 84.7° |
| N26 | C25 | H251 | H25 | 118.6° | 120.1° |
| C2 | C1 | C6 | C5 | 67.8° | 60.0° |
| C2 | C1 | C6 | H1 | 114.0° | 120.0° |
| C2 | C1 | C6 | C16 | 162.5° | 180.0° |
| C1 | C2 | H2 | H21 | 122.3° | 120.0° |
| C1 | C2 | C3 | H3 | 54.2° | 60.0° |
| C2 | C1 | N7 | HN7 | 14.2° | 38.9° |
| C2 | C1 | C6 | H6 | 47.0° | 60.0° |
| O19 | C5 | C6 | H5 | 117.5° | 120.0° |
| O19 | C5 | C6 | C1 | 176.0° | 180.0° |
| O19 | C5 | C6 | C16 | 46.9° | 59.9° |
| O19 | C5 | C4 | H4 | 54.5° | 60.0° |
| O19 | C5 | C6 | H6 | 69.3° | 60.0° |
| C5 | C6 | C1 | C16 | 129.6° | 120.0° |
| C5 | C6 | C1 | H6 | 114.8° | 120.0° |
| C5 | C6 | C16 | H6 | 116.1° | 119.9° |
| C5 | C6 | C16 | N20 | 42.6° | 65.0° |
| C5 | C6 | C1 | H1 | 178.2° | 180.0° |
| C6 | C5 | C4 | H4 | 68.3° | 60.0° |
| C5 | C6 | C16 | H16 | 163.7° | 55.0° |
| C5 | C6 | C16 | H161 | 78.5° | 175.0° |
| C6 | C5 | O19 | HO19 | 57.4° | 180.0° |
| C25 | C23 | C22 | N24 | 179.5° | 179.8° |
| C25 | C23 | C22 | N20 | 179.6° | 180.0° |
| C25 | C23 | N24 | N21 | 180.0° | 179.8° |
| C25 | C23 | C22 | H22 | 0.4° | 0.1° |
| C23 | C25 | H251 | H25 | 118.7° | 120.0° |
| C23 | C25 | N26 | HN26 | 45.5° | 0.1° |
| C1 | C6 | C16 | H6 | 115.3° | 120.0° |
| C1 | C6 | C16 | N20 | 86.0° | 175.0° |
| C6 | C1 | C2 | H2 | 174.1° | 60.0° |
| C6 | C1 | C2 | H21 | 52.5° | 180.0° |
| C1 | C6 | C5 | H5 | 58.5° | 60.0° |
| C6 | C1 | N7 | HN7 | 109.7° | 81.1° |
| C1 | C6 | C16 | H16 | 35.1° | 65.0° |
| C1 | C6 | C16 | H161 | 152.9° | 55.0° |
| C23 | C22 | N20 | H22 | 180.0° | 179.9° |
| C22 | C23 | N24 | N21 | 0.5° | 0.4° |
| C23 | C22 | N20 | N21 | 0.9° | 0.0° |
| C23 | C22 | N20 | C16 | 176.9° | 179.8° |
| C22 | C23 | C25 | H251 | 123.6° | 145.0° |
| C22 | C23 | C25 | H25 | 117.2° | 25.0° |
| N24 | C23 | C22 | N20 | 0.8° | 0.2° |
| C23 | N24 | N21 | N20 | 0.1° | 0.4° |
| N24 | C23 | C22 | H22 | 179.1° | 179.7° |
| N24 | C23 | C25 | H251 | 56.9° | 35.2° |
| N24 | C23 | C25 | H25 | 62.2° | 155.2° |
| C22 | N20 | C16 | C6 | 73.1° | 124.7° |
| C22 | N20 | N21 | N24 | 0.6° | 0.3° |
| C22 | N20 | N21 | C16 | 176.9° | 179.7° |
| C22 | N20 | C16 | H16 | 48.0° | 4.7° |
| C22 | N20 | C16 | H161 | 165.8° | 115.3° |
| C6 | C16 | N20 | N21 | 111.0° | 55.0° |
| C6 | C16 | N20 | H16 | 121.1° | 119.9° |
| C6 | C16 | N20 | H161 | 121.1° | 120.0° |
| C16 | C6 | C1 | H1 | 48.5° | 60.0° |
| C16 | C6 | C5 | H5 | 70.6° | 60.0° |
| C6 | C16 | H16 | H161 | 116.5° | 120.0° |
| N24 | N21 | N20 | C16 | 177.6° | 180.0° |
| N21 | N20 | C16 | H16 | 128.0° | 174.9° |
| N21 | N20 | C16 | H161 | 10.1° | 65.0° |
| N21 | N20 | C22 | H22 | 179.1° | 180.0° |
| N20 | C16 | C6 | H6 | 158.7° | 55.0° |
| N20 | C16 | H16 | H161 | 116.6° | 120.0° |
| C16 | N20 | C22 | H22 | 3.1° | 0.3° |
| H1 | C1 | C2 | H2 | 60.3° | 60.0° |
| H1 | C1 | C2 | H21 | 61.3° | 60.0° |
| H1 | C1 | N7 | HN7 | 130.0° | 158.9° |
| H1 | C1 | C6 | H6 | 67.0° | 60.0° |
| H2 | C2 | C3 | H3 | 65.1° | 180.0° |
| H21 | C2 | C3 | H3 | 173.4° | 59.9° |
| H3 | C3 | C4 | H4 | 180.0° | 180.0° |
| H3 | C3 | O17 | HO17 | 61.5° | 60.0° |
| H4 | C4 | C5 | H5 | 175.7° | 180.0° |
| H4 | C4 | O18 | HO18 | 60.2° | 60.1° |
| H5 | C5 | C6 | H6 | 173.2° | 180.0° |
| H5 | C5 | O19 | HO19 | 59.6° | 60.1° |
| HN7 | N7 | C8 | H81 | 179.2° | 64.0° |
| HN7 | N7 | C8 | H8 | 60.9° | 176.1° |
| H6 | C6 | C16 | H16 | 80.2° | 174.9° |
| H6 | C6 | C16 | H161 | 37.6° | 65.1° |
| H81 | C8 | C9 | H91 | 176.5° | 180.0° |
| H81 | C8 | C9 | H9 | 56.4° | 60.0° |
| H8 | C8 | C9 | H91 | 65.2° | 60.1° |
| H8 | C8 | C9 | H9 | 174.7° | 180.0° |
| H91 | C9 | C10 | H101 | 161.4° | 180.0° |
| H91 | C9 | C10 | H10 | 42.4° | 60.1° |
| H9 | C9 | C10 | H101 | 78.5° | 60.0° |
| H9 | C9 | C10 | H10 | 162.5° | 180.0° |
| H101 | C10 | C11 | H111 | 164.8° | 180.0° |
| H101 | C10 | C11 | H11 | 45.7° | 60.0° |
| H10 | C10 | C11 | H111 | 76.2° | 60.0° |
| H10 | C10 | C11 | H11 | 164.7° | 180.0° |
| H111 | C11 | C12 | H121 | 177.6° | 180.0° |
| H111 | C11 | C12 | H12 | 63.1° | 60.0° |
| H11 | C11 | C12 | H121 | 58.5° | 60.0° |
| H11 | C11 | C12 | H12 | 177.8° | 180.0° |
| H121 | C12 | C13 | H13 | 59.6° | 180.0° |
| H121 | C12 | C13 | H131 | 60.4° | 59.9° |
| H121 | C12 | C13 | H14 | 179.6° | 60.0° |
| H12 | C12 | C13 | H13 | 59.6° | 60.0° |
| H12 | C12 | C13 | H131 | 179.6° | 180.0° |
| H12 | C12 | C13 | H14 | 60.4° | 60.0° |
| H13 | C13 | H131 | H14 | 120.0° | 120.0° |
| H251 | C25 | N26 | HN26 | 165.9° | 120.0° |
| H25 | C25 | N26 | HN26 | 75.0° | 119.9° |
| H28 | C28 | H281 | H282 | 120.0° | 120.0° |
