T29
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1A | C1 | doub | 1.30Å | 1.31Å | |
| N1A | HN1 | sing | 0.97Å | 1.02Å | |
| N1B | C1 | sing | 1.37Å | 1.42Å | |
| N1B | HN11 | sing | 0.97Å | 1.02Å | |
| N1B | HN12 | sing | 0.97Å | 1.02Å | |
| C1 | S2 | sing | 1.76Å | 1.79Å | |
| S2 | C3 | sing | 1.81Å | 1.75Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.11Å | |
| C4 | C5 | sing | 1.53Å | 1.51Å | |
| C4 | H41 | sing | 1.09Å | 1.12Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | sing | 1.53Å | 1.57Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | B | sing | 1.57Å | 1.54Å | |
| C6 | N7 | sing | 1.46Å | 1.52Å | |
| C6 | H6 | sing | 1.09Å | 1.11Å | |
| B | O1A | sing | 1.42Å | 1.44Å | |
| B | O1B | sing | 1.42Å | 1.40Å | |
| O1A | HO1A | sing | 0.97Å | 0.95Å | |
| O1B | HO1B | sing | 0.97Å | 0.95Å | |
| N7 | C8 | sing | 1.35Å | 1.45Å | |
| N7 | HN7 | sing | 0.97Å | 1.02Å | |
| C8 | O8 | doub | 1.21Å | 1.24Å | |
| C8 | C9 | sing | 1.51Å | 1.52Å | |
| C9 | C9A | sing | 1.54Å | 1.59Å | |
| C9 | N10 | sing | 1.47Å | 1.47Å | |
| C9 | H9 | sing | 1.09Å | 1.12Å | |
| C9A | C9B | sing | 1.55Å | 1.60Å | |
| C9A | H9A1 | sing | 1.09Å | 1.11Å | |
| C9A | H9A2 | sing | 1.09Å | 1.12Å | |
| C9B | C9C | sing | 1.55Å | 1.55Å | |
| C9B | H9B1 | sing | 1.09Å | 1.11Å | |
| C9B | H9B2 | sing | 1.09Å | 1.12Å | |
| C9C | N10 | sing | 1.47Å | 1.49Å | |
| C9C | H9C1 | sing | 1.09Å | 1.11Å | |
| C9C | H9C2 | sing | 1.09Å | 1.12Å | |
| N10 | C11 | sing | 1.35Å | 1.42Å | |
| C11 | O11 | doub | 1.21Å | 1.26Å | |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C12 | C13 | sing | 1.53Å | 1.61Å | |
| C12 | N14 | sing | 1.46Å | 1.42Å | |
| C12 | H12 | sing | 1.09Å | 1.11Å | |
| C13 | C21 | sing | 1.51Å | 1.56Å | |
| C13 | H131 | sing | 1.09Å | 1.11Å | |
| C13 | H132 | sing | 1.09Å | 1.12Å | |
| C21 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å | |
| C23 | C24 | doub | 1.38Å | 1.43Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.38Å | 1.43Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.10Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.10Å | |
| N14 | C15 | sing | 1.35Å | 1.49Å | |
| N14 | HN4 | sing | 0.97Å | 1.02Å | |
| C15 | O15 | doub | 1.21Å | 1.23Å | |
| C15 | C16 | sing | 1.51Å | 1.55Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | H171 | sing | 1.09Å | 1.11Å | |
| C17 | H172 | sing | 1.09Å | 1.11Å | |
| C17 | H173 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1A | HN1 | 116.7° | 120.0° |
| N1A | C1 | N1B | 115.1° | 120.0° |
| N1A | C1 | S2 | 134.1° | 119.9° |
| C1 | N1B | HN11 | 115.2° | 120.0° |
| C1 | N1B | HN12 | 110.2° | 120.0° |
| N1B | C1 | S2 | 110.5° | 120.0° |
| HN11 | N1B | HN12 | 110.1° | 120.0° |
| C1 | S2 | C3 | 100.1° | 100.1° |
| S2 | C3 | C4 | 106.2° | 109.5° |
| S2 | C3 | H31 | 113.4° | 109.5° |
| S2 | C3 | H32 | 113.4° | 109.4° |
| C4 | C3 | H31 | 113.5° | 109.5° |
| C4 | C3 | H32 | 113.5° | 109.5° |
| C3 | C4 | C5 | 114.4° | 109.5° |
| C3 | C4 | H41 | 110.4° | 109.5° |
| C3 | C4 | H42 | 110.4° | 109.4° |
| H31 | C3 | H32 | 97.1° | 109.5° |
| C5 | C4 | H41 | 110.4° | 109.5° |
| C5 | C4 | H42 | 110.4° | 109.4° |
| C4 | C5 | C6 | 106.0° | 109.6° |
| C4 | C5 | H51 | 113.5° | 109.5° |
| C4 | C5 | H52 | 113.5° | 109.5° |
| H41 | C4 | H42 | 99.8° | 109.5° |
| C6 | C5 | H51 | 113.5° | 109.4° |
| C6 | C5 | H52 | 113.5° | 109.5° |
| C5 | C6 | B | 112.4° | 109.4° |
| C5 | C6 | N7 | 109.0° | 109.5° |
| C5 | C6 | H6 | 106.8° | 109.5° |
| H51 | C5 | H52 | 96.9° | 109.4° |
| B | C6 | N7 | 106.1° | 109.5° |
| B | C6 | H6 | 109.7° | 109.5° |
| C6 | B | O1A | 123.0° | 120.0° |
| C6 | B | O1B | 115.8° | 120.0° |
| N7 | C6 | H6 | 113.0° | 109.4° |
| C6 | N7 | C8 | 112.8° | 120.0° |
| C6 | N7 | HN7 | 125.6° | 120.0° |
| O1A | B | O1B | 104.9° | 120.0° |
| B | O1A | HO1A | 123.0° | 106.9° |
| B | O1B | HO1B | 115.8° | 106.8° |
| C8 | N7 | HN7 | 121.7° | 120.0° |
| N7 | C8 | O8 | 128.6° | 120.0° |
| N7 | C8 | C9 | 112.9° | 120.0° |
| O8 | C8 | C9 | 115.4° | 120.0° |
| C8 | C9 | C9A | 112.4° | 109.9° |
| C8 | C9 | N10 | 112.5° | 110.3° |
| C8 | C9 | H9 | 103.3° | 109.8° |
| C9A | C9 | N10 | 101.9° | 107.3° |
| C9A | C9 | H9 | 113.7° | 109.9° |
| C9 | C9A | C9B | 105.6° | 103.0° |
| C9 | C9A | H9A1 | 113.7° | 110.9° |
| C9 | C9A | H9A2 | 113.6° | 110.5° |
| N10 | C9 | H9 | 113.5° | 109.6° |
| C9 | N10 | C9C | 119.4° | 108.7° |
| C9 | N10 | C11 | 114.6° | 125.7° |
| C9B | C9A | H9A1 | 113.6° | 110.7° |
| C9B | C9A | H9A2 | 113.7° | 110.6° |
| C9A | C9B | C9C | 108.9° | 101.6° |
| C9A | C9B | H9B1 | 112.4° | 111.0° |
| C9A | C9B | H9B2 | 112.4° | 111.0° |
| H9A1 | C9A | H9A2 | 96.8° | 110.8° |
| C9C | C9B | H9B1 | 112.4° | 111.0° |
| C9C | C9B | H9B2 | 112.4° | 111.0° |
| C9B | C9C | N10 | 99.8° | 104.8° |
| C9B | C9C | H9C1 | 115.9° | 110.3° |
| C9B | C9C | H9C2 | 115.9° | 110.4° |
| H9B1 | C9B | H9B2 | 98.0° | 110.9° |
| N10 | C9C | H9C1 | 115.9° | 110.4° |
| N10 | C9C | H9C2 | 115.9° | 110.4° |
| C9C | N10 | C11 | 123.1° | 125.6° |
| H9C1 | C9C | H9C2 | 94.5° | 110.4° |
| N10 | C11 | O11 | 122.8° | 120.0° |
| N10 | C11 | C12 | 118.3° | 120.0° |
| O11 | C11 | C12 | 118.9° | 120.0° |
| C11 | C12 | C13 | 113.0° | 109.5° |
| C11 | C12 | N14 | 106.9° | 109.5° |
| C11 | C12 | H12 | 107.6° | 109.4° |
| C13 | C12 | N14 | 105.2° | 109.5° |
| C13 | C12 | H12 | 109.2° | 109.4° |
| C12 | C13 | C21 | 105.7° | 109.5° |
| C12 | C13 | H131 | 113.6° | 109.5° |
| C12 | C13 | H132 | 113.7° | 109.4° |
| N14 | C12 | H12 | 115.1° | 109.5° |
| C12 | N14 | C15 | 116.5° | 120.0° |
| C12 | N14 | HN4 | 119.4° | 120.1° |
| C21 | C13 | H131 | 113.6° | 109.5° |
| C21 | C13 | H132 | 113.6° | 109.5° |
| C13 | C21 | C22 | 118.6° | 120.0° |
| C13 | C21 | C26 | 122.6° | 120.0° |
| H131 | C13 | H132 | 96.9° | 109.4° |
| C22 | C21 | C26 | 118.7° | 120.0° |
| C21 | C22 | C23 | 121.4° | 120.0° |
| C21 | C22 | H22 | 119.2° | 120.0° |
| C21 | C26 | C25 | 121.3° | 120.0° |
| C21 | C26 | H26 | 120.4° | 119.9° |
| C23 | C22 | H22 | 119.3° | 120.0° |
| C22 | C23 | C24 | 119.1° | 120.1° |
| C22 | C23 | H23 | 119.8° | 120.0° |
| C24 | C23 | H23 | 121.1° | 120.0° |
| C23 | C24 | C25 | 119.3° | 120.0° |
| C23 | C24 | H24 | 120.4° | 120.0° |
| C25 | C24 | H24 | 120.3° | 120.0° |
| C24 | C25 | C26 | 120.1° | 120.0° |
| C24 | C25 | H25 | 121.3° | 120.0° |
| C26 | C25 | H25 | 118.6° | 120.0° |
| C25 | C26 | H26 | 118.3° | 120.1° |
| C15 | N14 | HN4 | 124.1° | 120.0° |
| N14 | C15 | O15 | 113.4° | 120.0° |
| N14 | C15 | C16 | 117.4° | 120.0° |
| O15 | C15 | C16 | 115.2° | 120.0° |
| C15 | C16 | C17 | 106.7° | 109.5° |
| C15 | C16 | H161 | 113.2° | 109.5° |
| C15 | C16 | H162 | 113.2° | 109.5° |
| C17 | C16 | H161 | 113.3° | 109.5° |
| C17 | C16 | H162 | 113.3° | 109.4° |
| C16 | C17 | H171 | 106.7° | 109.5° |
| C16 | C17 | H172 | 113.2° | 109.4° |
| C16 | C17 | H173 | 113.2° | 109.5° |
| H161 | C16 | H162 | 97.2° | 109.5° |
| H171 | C17 | H172 | 113.3° | 109.4° |
| H171 | C17 | H173 | 113.2° | 109.5° |
| H172 | C17 | H173 | 97.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1A | C1 | N1B | S2 | 175.0° | 180.0° |
| N1A | C1 | N1B | HN11 | 179.9° | 0.1° |
| N1A | C1 | N1B | HN12 | 54.8° | 179.9° |
| N1A | C1 | S2 | C3 | 1.2° | 0.0° |
| HN1 | N1A | C1 | N1B | 156.7° | 0.0° |
| HN1 | N1A | C1 | S2 | 29.9° | 180.0° |
| C1 | N1B | HN11 | HN12 | 125.3° | 179.9° |
| N1B | C1 | S2 | C3 | 172.5° | 180.0° |
| HN11 | N1B | C1 | S2 | 5.1° | 179.9° |
| HN12 | N1B | C1 | S2 | 130.3° | 0.1° |
| C1 | S2 | C3 | C4 | 170.2° | 180.0° |
| C1 | S2 | C3 | H31 | 44.9° | 60.0° |
| C1 | S2 | C3 | H32 | 64.6° | 60.0° |
| S2 | C3 | C4 | H31 | 125.2° | 120.0° |
| S2 | C3 | C4 | H32 | 125.2° | 119.9° |
| S2 | C3 | H31 | H32 | 119.4° | 119.9° |
| S2 | C3 | C4 | C5 | 48.9° | 180.0° |
| S2 | C3 | C4 | H41 | 76.3° | 59.9° |
| S2 | C3 | C4 | H42 | 174.2° | 60.0° |
| C4 | C3 | H31 | H32 | 119.4° | 120.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.0° |
| C3 | C4 | C5 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 116.2° | 119.9° |
| C3 | C4 | C5 | C6 | 171.3° | 180.0° |
| C3 | C4 | C5 | H51 | 46.0° | 59.9° |
| C3 | C4 | C5 | H52 | 63.4° | 60.0° |
| H31 | C3 | C4 | C5 | 174.2° | 60.0° |
| H31 | C3 | C4 | H41 | 48.9° | 179.9° |
| H31 | C3 | C4 | H42 | 60.5° | 60.0° |
| H32 | C3 | C4 | C5 | 76.3° | 60.1° |
| H32 | C3 | C4 | H41 | 158.5° | 60.0° |
| H32 | C3 | C4 | H42 | 49.0° | 180.0° |
| C5 | C4 | H41 | H42 | 116.3° | 120.0° |
| C4 | C5 | C6 | H51 | 125.3° | 120.1° |
| C4 | C5 | C6 | H52 | 125.2° | 120.0° |
| C4 | C5 | H51 | H52 | 119.4° | 120.0° |
| C4 | C5 | C6 | B | 167.0° | 60.0° |
| C4 | C5 | C6 | N7 | 75.7° | 180.0° |
| C4 | C5 | C6 | H6 | 46.7° | 60.0° |
| H41 | C4 | C5 | C6 | 63.4° | 60.0° |
| H41 | C4 | C5 | H51 | 171.3° | 180.0° |
| H41 | C4 | C5 | H52 | 61.8° | 60.1° |
| H42 | C4 | C5 | C6 | 46.1° | 60.0° |
| H42 | C4 | C5 | H51 | 79.2° | 60.0° |
| H42 | C4 | C5 | H52 | 171.3° | 180.0° |
| C6 | C5 | H51 | H52 | 119.4° | 119.9° |
| C5 | C6 | B | N7 | 119.0° | 120.1° |
| C5 | C6 | B | H6 | 118.7° | 120.0° |
| C5 | C6 | N7 | H6 | 118.6° | 120.0° |
| C5 | C6 | B | O1A | 56.7° | 60.0° |
| C5 | C6 | B | O1B | 172.4° | 119.9° |
| C5 | C6 | N7 | C8 | 107.9° | 150.0° |
| C5 | C6 | N7 | HN7 | 72.1° | 30.0° |
| H51 | C5 | C6 | B | 41.7° | 179.9° |
| H51 | C5 | C6 | N7 | 159.0° | 59.9° |
| H51 | C5 | C6 | H6 | 78.6° | 60.1° |
| H52 | C5 | C6 | B | 67.7° | 60.1° |
| H52 | C5 | C6 | N7 | 49.6° | 60.0° |
| H52 | C5 | C6 | H6 | 172.0° | 179.9° |
| B | C6 | N7 | H6 | 120.2° | 120.0° |
| C6 | B | O1A | O1B | 135.2° | 180.0° |
| C6 | B | O1A | HO1A | 179.9° | 180.0° |
| C6 | B | O1B | HO1B | 179.9° | 0.0° |
| B | C6 | N7 | C8 | 130.9° | 90.0° |
| B | C6 | N7 | HN7 | 49.1° | 90.0° |
| N7 | C6 | B | O1A | 175.7° | 60.0° |
| N7 | C6 | B | O1B | 53.4° | 120.0° |
| C6 | N7 | C8 | HN7 | 180.0° | 180.0° |
| C6 | N7 | C8 | O8 | 17.0° | 0.0° |
| C6 | N7 | C8 | C9 | 175.9° | 180.0° |
| H6 | C6 | B | O1A | 62.0° | 180.0° |
| H6 | C6 | B | O1B | 68.9° | 0.1° |
| H6 | C6 | N7 | C8 | 10.7° | 30.0° |
| H6 | C6 | N7 | HN7 | 169.3° | 150.0° |
| O1A | B | O1B | HO1B | 41.1° | 180.0° |
| O1B | B | O1A | HO1A | 44.8° | 0.1° |
| N7 | C8 | O8 | C9 | 158.5° | 180.0° |
| N7 | C8 | C9 | C9A | 89.3° | 61.4° |
| N7 | C8 | C9 | N10 | 156.4° | 179.5° |
| N7 | C8 | C9 | H9 | 33.6° | 59.6° |
| HN7 | N7 | C8 | O8 | 163.0° | 180.0° |
| HN7 | N7 | C8 | C9 | 4.1° | 0.0° |
| O8 | C8 | C9 | C9A | 72.6° | 118.6° |
| O8 | C8 | C9 | N10 | 41.7° | 0.5° |
| O8 | C8 | C9 | H9 | 164.5° | 120.4° |
| C8 | C9 | C9A | N10 | 120.6° | 119.9° |
| C8 | C9 | C9A | H9 | 116.9° | 121.0° |
| C8 | C9 | N10 | H9 | 116.9° | 121.0° |
| C8 | C9 | C9A | C9B | 123.0° | 141.7° |
| C8 | C9 | C9A | H9A1 | 2.3° | 99.8° |
| C8 | C9 | C9A | H9A2 | 111.7° | 23.5° |
| C8 | C9 | N10 | C9C | 108.4° | 118.2° |
| C8 | C9 | N10 | C11 | 52.9° | 61.5° |
| C9A | C9 | N10 | H9 | 122.6° | 119.3° |
| C9 | C9A | C9B | H9A1 | 125.3° | 118.6° |
| C9 | C9A | C9B | H9A2 | 125.2° | 118.2° |
| C9 | C9A | H9A1 | H9A2 | 119.6° | 123.2° |
| C9 | C9A | C9B | C9C | 14.7° | 35.3° |
| C9 | C9A | C9B | H9B1 | 140.0° | 82.8° |
| C9 | C9A | C9B | H9B2 | 110.5° | 153.4° |
| C9A | C9 | N10 | C9C | 12.1° | 1.4° |
| C9A | C9 | N10 | C11 | 173.4° | 178.9° |
| N10 | C9 | C9A | C9B | 2.4° | 21.8° |
| N10 | C9 | C9A | H9A1 | 122.9° | 140.3° |
| N10 | C9 | C9A | H9A2 | 127.6° | 96.4° |
| C9 | N10 | C9C | C9B | 20.8° | 24.4° |
| C9 | N10 | C9C | C11 | 159.7° | 179.7° |
| C9 | N10 | C9C | H9C1 | 104.5° | 143.1° |
| C9 | N10 | C9C | H9C2 | 146.1° | 94.4° |
| C9 | N10 | C11 | O11 | 7.1° | 0.3° |
| C9 | N10 | C11 | C12 | 172.2° | 179.7° |
| H9 | C9 | C9A | C9B | 120.1° | 97.3° |
| H9 | C9 | C9A | H9A1 | 114.6° | 21.2° |
| H9 | C9 | C9A | H9A2 | 5.1° | 144.5° |
| H9 | C9 | N10 | C9C | 134.7° | 120.7° |
| H9 | C9 | N10 | C11 | 64.0° | 59.6° |
| C9B | C9A | H9A1 | H9A2 | 119.6° | 123.1° |
| C9A | C9B | C9C | H9B1 | 125.3° | 118.1° |
| C9A | C9B | C9C | H9B2 | 125.2° | 118.1° |
| C9A | C9B | H9B1 | H9B2 | 118.3° | 123.9° |
| C9A | C9B | C9C | N10 | 20.0° | 37.0° |
| C9A | C9B | C9C | H9C1 | 105.2° | 155.8° |
| C9A | C9B | C9C | H9C2 | 145.3° | 81.9° |
| H9A1 | C9A | C9B | C9C | 110.6° | 153.9° |
| H9A1 | C9A | C9B | H9B1 | 14.7° | 35.8° |
| H9A1 | C9A | C9B | H9B2 | 124.2° | 88.0° |
| H9A2 | C9A | C9B | C9C | 139.9° | 82.9° |
| H9A2 | C9A | C9B | H9B1 | 94.8° | 159.1° |
| H9A2 | C9A | C9B | H9B2 | 14.7° | 35.2° |
| C9C | C9B | H9B1 | H9B2 | 118.4° | 123.9° |
| C9B | C9C | N10 | H9C1 | 125.3° | 118.8° |
| C9B | C9C | N10 | H9C2 | 125.2° | 118.8° |
| C9B | C9C | H9C1 | H9C2 | 121.7° | 122.3° |
| C9B | C9C | N10 | C11 | 179.5° | 155.9° |
| H9B1 | C9B | C9C | N10 | 145.3° | 81.1° |
| H9B1 | C9B | C9C | H9C1 | 20.0° | 37.8° |
| H9B1 | C9B | C9C | H9C2 | 89.5° | 160.1° |
| H9B2 | C9B | C9C | N10 | 105.2° | 155.1° |
| H9B2 | C9B | C9C | H9C1 | 129.6° | 86.1° |
| H9B2 | C9B | C9C | H9C2 | 20.1° | 36.2° |
| N10 | C9C | H9C1 | H9C2 | 121.7° | 122.4° |
| C9C | N10 | C11 | O11 | 167.6° | 180.0° |
| C9C | N10 | C11 | C12 | 11.6° | 0.1° |
| H9C1 | C9C | N10 | C11 | 55.2° | 37.2° |
| H9C2 | C9C | N10 | C11 | 54.3° | 85.3° |
| N10 | C11 | O11 | C12 | 179.3° | 179.9° |
| N10 | C11 | C12 | C13 | 110.6° | 89.9° |
| N10 | C11 | C12 | N14 | 134.2° | 150.0° |
| N10 | C11 | C12 | H12 | 10.0° | 30.0° |
| O11 | C11 | C12 | C13 | 70.1° | 90.0° |
| O11 | C11 | C12 | N14 | 45.1° | 30.1° |
| O11 | C11 | C12 | H12 | 169.3° | 150.0° |
| C11 | C12 | C13 | N14 | 116.2° | 120.1° |
| C11 | C12 | C13 | H12 | 119.7° | 120.0° |
| C11 | C12 | N14 | H12 | 119.4° | 119.9° |
| C11 | C12 | C13 | C21 | 76.6° | 180.0° |
| C11 | C12 | C13 | H131 | 48.7° | 59.9° |
| C11 | C12 | C13 | H132 | 158.2° | 60.0° |
| C11 | C12 | N14 | C15 | 132.8° | 60.1° |
| C11 | C12 | N14 | HN4 | 47.2° | 120.0° |
| C13 | C12 | N14 | H12 | 120.2° | 120.0° |
| C12 | C13 | C21 | H131 | 125.3° | 120.0° |
| C12 | C13 | C21 | H132 | 125.3° | 120.0° |
| C12 | C13 | H131 | H132 | 119.6° | 119.9° |
| C12 | C13 | C21 | C22 | 117.5° | 90.0° |
| C12 | C13 | C21 | C26 | 58.5° | 90.3° |
| C13 | C12 | N14 | C15 | 106.9° | 60.0° |
| C13 | C12 | N14 | HN4 | 73.1° | 119.9° |
| N14 | C12 | C13 | C21 | 167.2° | 60.0° |
| N14 | C12 | C13 | H131 | 67.5° | 180.0° |
| N14 | C12 | C13 | H132 | 42.0° | 60.1° |
| C12 | N14 | C15 | HN4 | 180.0° | 180.0° |
| C12 | N14 | C15 | O15 | 28.3° | 0.1° |
| C12 | N14 | C15 | C16 | 110.1° | 180.0° |
| H12 | C12 | C13 | C21 | 43.1° | 60.0° |
| H12 | C12 | C13 | H131 | 168.4° | 60.0° |
| H12 | C12 | C13 | H132 | 82.1° | 179.9° |
| H12 | C12 | N14 | C15 | 13.3° | 180.0° |
| H12 | C12 | N14 | HN4 | 166.7° | 0.0° |
| C21 | C13 | H131 | H132 | 119.5° | 120.1° |
| C13 | C21 | C22 | C26 | 176.2° | 179.7° |
| C13 | C21 | C22 | C23 | 173.5° | 179.9° |
| C13 | C21 | C22 | H22 | 6.5° | 0.0° |
| C13 | C21 | C26 | C25 | 174.5° | 179.8° |
| C13 | C21 | C26 | H26 | 5.5° | 0.3° |
| H131 | C13 | C21 | C22 | 7.8° | 30.0° |
| H131 | C13 | C21 | C26 | 176.2° | 149.7° |
| H132 | C13 | C21 | C22 | 117.2° | 150.0° |
| H132 | C13 | C21 | C26 | 66.8° | 29.7° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 1.5° | 0.0° |
| C21 | C22 | C23 | H23 | 178.5° | 179.9° |
| C22 | C21 | C26 | C25 | 1.5° | 0.5° |
| C22 | C21 | C26 | H26 | 178.5° | 179.9° |
| C26 | C21 | C22 | C23 | 2.6° | 0.3° |
| C26 | C21 | C22 | H22 | 177.4° | 179.7° |
| C21 | C26 | C25 | C24 | 0.8° | 0.4° |
| C21 | C26 | C25 | H26 | 180.0° | 179.6° |
| C21 | C26 | C25 | H25 | 179.2° | 179.7° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.8° | 0.0° |
| C22 | C23 | C24 | H24 | 179.2° | 179.9° |
| H22 | C22 | C23 | C24 | 178.5° | 180.0° |
| H22 | C22 | C23 | H23 | 1.4° | 0.1° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 2.0° | 0.2° |
| C23 | C24 | C25 | H25 | 178.0° | 180.0° |
| H23 | C23 | C24 | C25 | 179.1° | 180.0° |
| H23 | C23 | C24 | H24 | 0.8° | 0.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | H26 | 179.2° | 180.0° |
| H24 | C24 | C25 | C26 | 178.1° | 179.9° |
| H24 | C24 | C25 | H25 | 1.9° | 0.0° |
| H25 | C25 | C26 | H26 | 0.8° | 0.2° |
| N14 | C15 | O15 | C16 | 139.3° | 179.9° |
| N14 | C15 | C16 | C17 | 75.4° | 180.0° |
| N14 | C15 | C16 | H161 | 49.9° | 60.0° |
| N14 | C15 | C16 | H162 | 159.3° | 60.0° |
| HN4 | N14 | C15 | O15 | 151.7° | 180.0° |
| HN4 | N14 | C15 | C16 | 69.9° | 0.0° |
| O15 | C15 | C16 | C17 | 147.0° | 0.0° |
| O15 | C15 | C16 | H161 | 87.7° | 120.1° |
| O15 | C15 | C16 | H162 | 21.7° | 119.9° |
| C15 | C16 | C17 | H161 | 125.2° | 120.0° |
| C15 | C16 | C17 | H162 | 125.2° | 120.0° |
| C15 | C16 | H161 | H162 | 119.1° | 120.0° |
| C15 | C16 | C17 | H171 | 180.0° | 180.0° |
| C15 | C16 | C17 | H172 | 54.7° | 60.0° |
| C15 | C16 | C17 | H173 | 54.7° | 60.0° |
| C17 | C16 | H161 | H162 | 119.3° | 120.0° |
| C16 | C17 | H171 | H172 | 125.3° | 120.0° |
| C16 | C17 | H171 | H173 | 125.2° | 120.0° |
| C16 | C17 | H172 | H173 | 119.1° | 120.0° |
| H161 | C16 | C17 | H171 | 54.7° | 60.0° |
| H161 | C16 | C17 | H172 | 179.9° | 60.0° |
| H161 | C16 | C17 | H173 | 70.5° | NaN° |
| H162 | C16 | C17 | H171 | 54.8° | 60.0° |
| H162 | C16 | C17 | H172 | 70.5° | 180.0° |
| H162 | C16 | C17 | H173 | 180.0° | 60.0° |
| H171 | C17 | H172 | H173 | 119.2° | 120.0° |
