6KZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C2 | sing | 1.53Å | 1.55Å | |
| C3 | N4 | sing | 1.47Å | 1.49Å | |
| C2 | O1 | sing | 1.43Å | 1.47Å | |
| O1 | C6 | sing | 1.43Å | 1.46Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | N4 | sing | 1.47Å | 1.50Å | |
| N4 | C7 | sing | 1.35Å | 1.35Å | |
| C7 | O28 | doub | 1.22Å | 1.23Å | |
| C7 | N8 | sing | 1.35Å | 1.34Å | |
| N8 | C9 | sing | 1.46Å | 1.47Å | |
| C9 | C27 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.51Å | 1.55Å | |
| C27 | C31 | sing | 1.53Å | 1.54Å | |
| C31 | C33 | sing | 1.53Å | 1.54Å | |
| C31 | C32 | sing | 1.53Å | 1.54Å | |
| C10 | O29 | doub | 1.21Å | 1.24Å | |
| C10 | N11 | sing | 1.35Å | 1.35Å | |
| N11 | C12 | sing | 1.46Å | 1.47Å | |
| C12 | C13 | sing | 1.53Å | 1.55Å | |
| C12 | C15 | sing | 1.53Å | 1.55Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | O30 | sing | 1.43Å | 1.47Å | |
| C15 | C16 | sing | 1.51Å | 1.54Å | |
| C16 | N20 | sing | 1.34Å | 1.33Å | Aromatic |
| C16 | N17 | doub | 1.30Å | 1.33Å | Aromatic |
| N20 | C19 | doub | 1.32Å | 1.32Å | Aromatic |
| N17 | O18 | sing | 1.21Å | 1.40Å | Aromatic |
| O18 | C19 | sing | 1.34Å | 1.37Å | Aromatic |
| C19 | C21 | sing | 1.48Å | 1.40Å | |
| C21 | C22 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | C26 | doub | 1.40Å | 1.40Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.41Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| N8 | H8 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C33 | H333 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H323 | sing | 1.09Å | 1.10Å | |
| N11 | H11 | sing | 0.97Å | 1.00Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| O30 | H30 | sing | 0.97Å | 0.95Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C3 | N4 | 114.2° | 108.4° |
| C3 | C2 | O1 | 116.2° | 109.2° |
| C2 | C3 | H31C | 108.3° | 109.7° |
| C2 | C3 | H32C | 108.3° | 109.7° |
| C3 | C2 | H21C | 107.7° | 109.5° |
| C3 | C2 | H22C | 107.8° | 109.5° |
| C3 | N4 | C5 | 120.8° | 118.0° |
| C3 | N4 | C7 | 119.7° | 121.0° |
| N4 | C3 | H31C | 108.3° | 109.7° |
| N4 | C3 | H32C | 108.3° | 109.7° |
| C2 | O1 | C6 | 109.5° | 114.2° |
| O1 | C2 | H21C | 107.8° | 109.5° |
| O1 | C2 | H22C | 107.8° | 109.6° |
| O1 | C6 | C5 | 109.1° | 109.2° |
| O1 | C6 | H61C | 109.5° | 109.5° |
| O1 | C6 | H62C | 109.6° | 109.5° |
| C6 | C5 | N4 | 113.0° | 108.4° |
| C5 | C6 | H61C | 109.6° | 109.5° |
| C5 | C6 | H62C | 109.6° | 109.5° |
| C6 | C5 | H51C | 108.6° | 109.7° |
| C6 | C5 | H52C | 108.6° | 109.7° |
| C5 | N4 | C7 | 119.4° | 121.0° |
| N4 | C5 | H51C | 108.6° | 109.7° |
| N4 | C5 | H52C | 108.6° | 109.7° |
| N4 | C7 | O28 | 118.7° | 120.0° |
| N4 | C7 | N8 | 119.2° | 120.0° |
| O28 | C7 | N8 | 122.0° | 120.0° |
| C7 | N8 | C9 | 122.5° | 120.0° |
| C7 | N8 | H8 | 118.7° | 120.0° |
| N8 | C9 | C27 | 108.6° | 109.5° |
| N8 | C9 | C10 | 109.1° | 109.5° |
| C9 | N8 | H8 | 118.7° | 120.0° |
| N8 | C9 | H9 | 110.1° | 109.5° |
| C27 | C9 | C10 | 110.7° | 109.5° |
| C9 | C27 | C31 | 110.0° | 109.4° |
| C27 | C9 | H9 | 109.3° | 109.5° |
| C9 | C27 | H271 | 109.3° | 109.5° |
| C9 | C27 | H272 | 109.4° | 109.5° |
| C9 | C10 | O29 | 121.2° | 120.0° |
| C9 | C10 | N11 | 115.7° | 120.0° |
| C10 | C9 | H9 | 109.1° | 109.5° |
| C27 | C31 | C33 | 112.5° | 109.4° |
| C27 | C31 | C32 | 111.2° | 109.5° |
| C31 | C27 | H271 | 109.3° | 109.4° |
| C31 | C27 | H272 | 109.3° | 109.4° |
| C27 | C31 | H31 | 107.5° | 109.4° |
| C33 | C31 | C32 | 110.5° | 109.5° |
| C33 | C31 | H31 | 107.4° | 109.5° |
| C31 | C33 | H331 | 109.5° | 109.4° |
| C31 | C33 | H332 | 109.5° | 109.4° |
| C31 | C33 | H333 | 109.5° | 109.5° |
| C32 | C31 | H31 | 107.5° | 109.5° |
| C31 | C32 | H321 | 109.5° | 109.4° |
| C31 | C32 | H322 | 109.5° | 109.4° |
| C31 | C32 | H323 | 109.5° | 109.4° |
| O29 | C10 | N11 | 122.8° | 120.0° |
| C10 | N11 | C12 | 118.5° | 120.0° |
| C10 | N11 | H11 | 120.7° | 120.0° |
| N11 | C12 | C13 | 111.2° | 109.5° |
| N11 | C12 | C15 | 107.2° | 109.4° |
| C12 | N11 | H11 | 120.7° | 120.0° |
| N11 | C12 | H12 | 109.5° | 109.5° |
| C13 | C12 | C15 | 111.7° | 109.4° |
| C12 | C13 | C14 | 110.0° | 109.4° |
| C13 | C12 | H12 | 108.6° | 109.5° |
| C12 | C13 | H131 | 109.3° | 109.4° |
| C12 | C13 | H132 | 109.3° | 109.5° |
| C12 | C15 | O30 | 109.0° | 109.5° |
| C12 | C15 | C16 | 112.9° | 109.5° |
| C12 | C15 | H15 | 110.3° | 109.5° |
| C15 | C12 | H12 | 108.6° | 109.5° |
| C14 | C13 | H131 | 109.4° | 109.5° |
| C14 | C13 | H132 | 109.4° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.4° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| O30 | C15 | C16 | 102.7° | 109.5° |
| O30 | C15 | H15 | 111.4° | 109.5° |
| C15 | O30 | H30 | 109.5° | 114.0° |
| C15 | C16 | N20 | 124.9° | 126.2° |
| C15 | C16 | N17 | 122.9° | 126.2° |
| C16 | C15 | H15 | 110.4° | 109.5° |
| N20 | C16 | N17 | 112.2° | 107.6° |
| C16 | N20 | C19 | 107.9° | 105.6° |
| C16 | N17 | O18 | 104.4° | 110.5° |
| N20 | C19 | O18 | 108.1° | 106.7° |
| N20 | C19 | C21 | 128.1° | 126.7° |
| N17 | O18 | C19 | 107.4° | 109.7° |
| O18 | C19 | C21 | 123.7° | 126.7° |
| C19 | C21 | C22 | 119.7° | 120.1° |
| C19 | C21 | C26 | 120.1° | 120.1° |
| C22 | C21 | C26 | 120.1° | 119.7° |
| C21 | C22 | C23 | 120.9° | 119.8° |
| C21 | C22 | H22 | 119.6° | 120.1° |
| C21 | C26 | C25 | 119.2° | 119.8° |
| C21 | C26 | H26 | 120.4° | 120.1° |
| C22 | C23 | C24 | 118.8° | 120.1° |
| C23 | C22 | H22 | 119.5° | 120.1° |
| C22 | C23 | H23 | 120.6° | 119.9° |
| C23 | C24 | C25 | 120.4° | 120.3° |
| C24 | C23 | H23 | 120.6° | 120.0° |
| C23 | C24 | H24 | 119.8° | 119.8° |
| C24 | C25 | C26 | 120.5° | 120.1° |
| C25 | C24 | H24 | 119.8° | 119.9° |
| C24 | C25 | H25 | 119.8° | 120.0° |
| C25 | C26 | H26 | 120.4° | 120.0° |
| C26 | C25 | H25 | 119.7° | 119.9° |
| H31C | C3 | H32C | 109.4° | 109.7° |
| H21C | C2 | H22C | 109.5° | 109.6° |
| H61C | C6 | H62C | 109.5° | 109.6° |
| H51C | C5 | H52C | 109.5° | 109.8° |
| H271 | C27 | H272 | 109.5° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.4° |
| H331 | C33 | H333 | 109.4° | 109.5° |
| H332 | C33 | H333 | 109.5° | 109.5° |
| H321 | C32 | H322 | 109.4° | 109.5° |
| H321 | C32 | H323 | 109.5° | 109.5° |
| H322 | C32 | H323 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.4° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H141 | C14 | H143 | 109.4° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C3 | N4 | H31C | 120.7° | 119.7° |
| C2 | C3 | N4 | H32C | 120.7° | 119.7° |
| C3 | C2 | O1 | H21C | 121.0° | 119.9° |
| C3 | C2 | O1 | H22C | 121.0° | 119.9° |
| C3 | C2 | O1 | C6 | 55.6° | 62.6° |
| C2 | C3 | N4 | C5 | 12.1° | 50.5° |
| C2 | C3 | N4 | C7 | 169.2° | 129.5° |
| C2 | C3 | H31C | H32C | 117.9° | 120.6° |
| C3 | C2 | H21C | H22C | 116.9° | 120.1° |
| N4 | C3 | C2 | O1 | 26.8° | 52.3° |
| C3 | N4 | C5 | C6 | 25.0° | 50.6° |
| C3 | N4 | C5 | C7 | 178.7° | 180.0° |
| C3 | N4 | C7 | O28 | 178.8° | 5.0° |
| C3 | N4 | C7 | N8 | 2.1° | 175.0° |
| N4 | C3 | H31C | H32C | 117.8° | 120.5° |
| N4 | C3 | C2 | H21C | 94.2° | 67.6° |
| N4 | C3 | C2 | H22C | 147.8° | 172.2° |
| C3 | N4 | C5 | H51C | 145.5° | 170.2° |
| C3 | N4 | C5 | H52C | 95.5° | 69.2° |
| C2 | O1 | C6 | C5 | 67.4° | 62.6° |
| O1 | C2 | C3 | H31C | 93.9° | 67.4° |
| O1 | C2 | C3 | H32C | 147.5° | 172.0° |
| O1 | C2 | H21C | H22C | 116.9° | 120.2° |
| C2 | O1 | C6 | H61C | 52.6° | 57.3° |
| C2 | O1 | C6 | H62C | 172.7° | 177.5° |
| O1 | C6 | C5 | H61C | 119.9° | 119.9° |
| O1 | C6 | C5 | H62C | 120.0° | 119.9° |
| O1 | C6 | C5 | N4 | 52.0° | 52.3° |
| C6 | O1 | C2 | H21C | 65.3° | 57.3° |
| C6 | O1 | C2 | H22C | 176.6° | 177.5° |
| O1 | C6 | H61C | H62C | 120.2° | 120.1° |
| O1 | C6 | C5 | H51C | 172.6° | 172.0° |
| O1 | C6 | C5 | H52C | 68.5° | 67.4° |
| C6 | C5 | N4 | H51C | 120.5° | 119.7° |
| C6 | C5 | N4 | H52C | 120.5° | 119.7° |
| C6 | C5 | N4 | C7 | 156.3° | 129.5° |
| C5 | C6 | H61C | H62C | 120.2° | 120.1° |
| C6 | C5 | H51C | H52C | 118.4° | 120.5° |
| C5 | N4 | C7 | O28 | 0.1° | 175.0° |
| C5 | N4 | C7 | N8 | 179.2° | 5.0° |
| C5 | N4 | C3 | H31C | 108.6° | 69.2° |
| C5 | N4 | C3 | H32C | 132.9° | 170.2° |
| N4 | C5 | C6 | H61C | 67.9° | 67.6° |
| N4 | C5 | C6 | H62C | 172.0° | 172.2° |
| N4 | C5 | H51C | H52C | 118.4° | 120.5° |
| N4 | C7 | O28 | N8 | 179.1° | 180.0° |
| N4 | C7 | N8 | C9 | 178.8° | 174.5° |
| C7 | N4 | C3 | H31C | 70.1° | 110.8° |
| C7 | N4 | C3 | H32C | 48.5° | 9.8° |
| C7 | N4 | C5 | H51C | 35.8° | 9.8° |
| C7 | N4 | C5 | H52C | 83.1° | 110.8° |
| N4 | C7 | N8 | H8 | 1.2° | 5.5° |
| O28 | C7 | N8 | C9 | 0.4° | 5.5° |
| O28 | C7 | N8 | H8 | 179.7° | 174.5° |
| C7 | N8 | C9 | H8 | 180.0° | 180.0° |
| C7 | N8 | C9 | C27 | 163.7° | 85.0° |
| C7 | N8 | C9 | C10 | 75.5° | 155.0° |
| C7 | N8 | C9 | H9 | 44.1° | 35.0° |
| N8 | C9 | C27 | C10 | 119.8° | 120.0° |
| N8 | C9 | C27 | H9 | 120.1° | 120.0° |
| N8 | C9 | C10 | H9 | 120.3° | 120.0° |
| N8 | C9 | C27 | C31 | 65.2° | 65.0° |
| N8 | C9 | C10 | O29 | 38.9° | 0.0° |
| N8 | C9 | C10 | N11 | 134.6° | 180.0° |
| N8 | C9 | C27 | H271 | 54.8° | 54.9° |
| N8 | C9 | C27 | H272 | 174.7° | 175.0° |
| C27 | C9 | C10 | H9 | 120.3° | 120.0° |
| C9 | C27 | C31 | H271 | 120.1° | 120.0° |
| C9 | C27 | C31 | H272 | 120.1° | 120.0° |
| C9 | C27 | C31 | C33 | 151.2° | 175.0° |
| C9 | C27 | C31 | C32 | 84.3° | 65.0° |
| C27 | C9 | C10 | O29 | 80.6° | 120.0° |
| C27 | C9 | C10 | N11 | 106.0° | 60.0° |
| C27 | C9 | N8 | H8 | 16.3° | 95.0° |
| C9 | C27 | H271 | H272 | 119.8° | 120.1° |
| C9 | C27 | C31 | H31 | 33.1° | 55.0° |
| C10 | C9 | C27 | C31 | 175.0° | 175.0° |
| C9 | C10 | O29 | N11 | 172.9° | 179.9° |
| C9 | C10 | N11 | C12 | 179.0° | 180.0° |
| C10 | C9 | N8 | H8 | 104.5° | 25.0° |
| C10 | C9 | C27 | H271 | 64.9° | 65.0° |
| C10 | C9 | C27 | H272 | 54.9° | 55.1° |
| C9 | C10 | N11 | H11 | 0.9° | 0.0° |
| C27 | C31 | C33 | C32 | 124.9° | 120.0° |
| C27 | C31 | C33 | H31 | 118.1° | 120.0° |
| C27 | C31 | C32 | H31 | 117.4° | 120.0° |
| C31 | C27 | C9 | H9 | 54.8° | 55.0° |
| C31 | C27 | H271 | H272 | 119.7° | 120.0° |
| C27 | C31 | C33 | H331 | 180.0° | 60.0° |
| C27 | C31 | C33 | H332 | 60.0° | 179.9° |
| C27 | C31 | C33 | H333 | 60.0° | 60.0° |
| C27 | C31 | C32 | H321 | 180.0° | 60.0° |
| C27 | C31 | C32 | H322 | 60.0° | 180.0° |
| C27 | C31 | C32 | H323 | 60.0° | 60.0° |
| C33 | C31 | C32 | H31 | 117.0° | 120.1° |
| C33 | C31 | C27 | H271 | 31.1° | 55.0° |
| C33 | C31 | C27 | H272 | 88.7° | 65.0° |
| C31 | C33 | H331 | H332 | 120.0° | 119.9° |
| C31 | C33 | H331 | H333 | 120.0° | 120.1° |
| C31 | C33 | H332 | H333 | 120.0° | 120.0° |
| C33 | C31 | C32 | H321 | 54.3° | 180.0° |
| C33 | C31 | C32 | H322 | 65.6° | 60.0° |
| C33 | C31 | C32 | H323 | 174.4° | 60.0° |
| C32 | C31 | C27 | H271 | 155.6° | 175.0° |
| C32 | C31 | C27 | H272 | 35.8° | 55.0° |
| C32 | C31 | C33 | H331 | 55.1° | 59.9° |
| C32 | C31 | C33 | H332 | 175.1° | 60.0° |
| C32 | C31 | C33 | H333 | 64.9° | 180.0° |
| C31 | C32 | H321 | H322 | 120.0° | 120.0° |
| C31 | C32 | H321 | H323 | 120.0° | 120.0° |
| C31 | C32 | H322 | H323 | 120.0° | 120.0° |
| O29 | C10 | N11 | C12 | 7.7° | 0.0° |
| O29 | C10 | C9 | H9 | 159.1° | 120.0° |
| O29 | C10 | N11 | H11 | 172.4° | 180.0° |
| C10 | N11 | C12 | H11 | 180.0° | 180.0° |
| C10 | N11 | C12 | C13 | 118.1° | 85.0° |
| C10 | N11 | C12 | C15 | 119.5° | 155.0° |
| N11 | C10 | C9 | H9 | 14.3° | 60.0° |
| C10 | N11 | C12 | H12 | 1.9° | 35.0° |
| N11 | C12 | C13 | C15 | 119.8° | 120.0° |
| N11 | C12 | C13 | H12 | 120.6° | 120.1° |
| N11 | C12 | C15 | H12 | 118.3° | 120.1° |
| N11 | C12 | C13 | C14 | 67.7° | 65.0° |
| N11 | C12 | C15 | O30 | 58.1° | 60.0° |
| N11 | C12 | C15 | C16 | 55.3° | 60.0° |
| N11 | C12 | C15 | H15 | 179.3° | 180.0° |
| N11 | C12 | C13 | H131 | 52.4° | 54.9° |
| N11 | C12 | C13 | H132 | 172.1° | 175.0° |
| C13 | C12 | C15 | H12 | 119.7° | 120.0° |
| C12 | C13 | C14 | H131 | 120.1° | 119.9° |
| C12 | C13 | C14 | H132 | 120.1° | 120.0° |
| C13 | C12 | C15 | O30 | 63.9° | 60.0° |
| C13 | C12 | C15 | C16 | 177.3° | 180.0° |
| C13 | C12 | C15 | H15 | 58.7° | 60.0° |
| C13 | C12 | N11 | H11 | 62.0° | 95.0° |
| C12 | C13 | H131 | H132 | 119.7° | 120.0° |
| C12 | C13 | C14 | H141 | 180.0° | 180.0° |
| C12 | C13 | C14 | H142 | 60.0° | 60.0° |
| C12 | C13 | C14 | H143 | 60.0° | 60.0° |
| C15 | C12 | C13 | C14 | 172.5° | 175.0° |
| C12 | C15 | O30 | C16 | 119.9° | 120.0° |
| C12 | C15 | O30 | H15 | 121.9° | 120.0° |
| C12 | C15 | C16 | H15 | 123.9° | 120.0° |
| C12 | C15 | C16 | N20 | 54.5° | 105.0° |
| C12 | C15 | C16 | N17 | 125.6° | 75.3° |
| C15 | C12 | N11 | H11 | 60.4° | 25.0° |
| C15 | C12 | C13 | H131 | 67.4° | 65.0° |
| C15 | C12 | C13 | H132 | 52.4° | 55.0° |
| C12 | C15 | O30 | H30 | 180.0° | 60.0° |
| C14 | C13 | C12 | H12 | 52.8° | 55.1° |
| C14 | C13 | H131 | H132 | 119.8° | 120.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.0° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| O30 | C15 | C16 | H15 | 118.9° | 120.0° |
| O30 | C15 | C16 | N20 | 171.7° | 135.0° |
| O30 | C15 | C16 | N17 | 8.4° | 44.7° |
| O30 | C15 | C12 | H12 | 176.4° | 180.0° |
| C15 | C16 | N20 | N17 | 179.9° | 179.7° |
| C15 | C16 | N20 | C19 | 178.8° | 180.0° |
| C15 | C16 | N17 | O18 | 179.7° | 180.0° |
| C16 | C15 | C12 | H12 | 63.0° | 60.0° |
| C16 | C15 | O30 | H30 | 60.0° | 60.0° |
| N20 | C16 | N17 | O18 | 0.4° | 0.3° |
| C16 | N20 | C19 | O18 | 1.6° | 0.2° |
| C16 | N20 | C19 | C21 | 178.1° | 180.0° |
| N20 | C16 | C15 | H15 | 69.5° | 15.0° |
| N17 | C16 | N20 | C19 | 1.3° | 0.3° |
| C16 | N17 | O18 | C19 | 0.6° | 0.1° |
| N17 | C16 | C15 | H15 | 110.4° | 164.7° |
| N20 | C19 | O18 | N17 | 1.4° | 0.1° |
| N20 | C19 | O18 | C21 | 176.7° | 179.8° |
| N20 | C19 | C21 | C22 | 6.5° | 180.0° |
| N20 | C19 | C21 | C26 | 170.1° | 0.3° |
| N17 | O18 | C19 | C21 | 178.0° | 179.9° |
| O18 | C19 | C21 | C22 | 177.5° | 0.2° |
| O18 | C19 | C21 | C26 | 5.9° | 179.9° |
| C19 | C21 | C22 | C26 | 176.6° | 179.7° |
| C19 | C21 | C22 | C23 | 179.4° | 180.0° |
| C19 | C21 | C26 | C25 | 179.1° | 179.8° |
| C19 | C21 | C22 | H22 | 0.6° | 0.1° |
| C19 | C21 | C26 | H26 | 0.9° | 0.0° |
| C21 | C22 | C23 | H22 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 1.3° | 0.0° |
| C22 | C21 | C26 | C25 | 2.6° | 0.5° |
| C22 | C21 | C26 | H26 | 177.4° | 179.8° |
| C21 | C22 | C23 | H23 | 178.7° | 180.0° |
| C26 | C21 | C22 | C23 | 2.8° | 0.3° |
| C21 | C26 | C25 | C24 | 0.9° | 0.5° |
| C21 | C26 | C25 | H26 | 180.0° | 179.7° |
| C26 | C21 | C22 | H22 | 177.2° | 179.8° |
| C21 | C26 | C25 | H25 | 179.1° | 179.7° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.4° | 0.1° |
| C22 | C23 | C24 | H24 | 179.6° | 180.0° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.5° | 0.3° |
| C24 | C23 | C22 | H22 | 178.7° | 180.0° |
| C23 | C24 | C25 | H25 | 179.5° | 179.9° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | H26 | 179.1° | 179.8° |
| C25 | C24 | C23 | H23 | 179.6° | 180.0° |
| C26 | C25 | C24 | H24 | 179.4° | 179.8° |
| H15 | C15 | C12 | H12 | 61.0° | 59.9° |
| H15 | C15 | O30 | H30 | 58.1° | 180.0° |
| H31C | C3 | C2 | H21C | 145.1° | 172.6° |
| H31C | C3 | C2 | H22C | 27.1° | 52.5° |
| H32C | C3 | C2 | H21C | 26.6° | 52.1° |
| H32C | C3 | C2 | H22C | 91.5° | 68.1° |
| H61C | C6 | C5 | H51C | 52.6° | 52.1° |
| H61C | C6 | C5 | H52C | 171.6° | 172.7° |
| H62C | C6 | C5 | H51C | 67.5° | 68.1° |
| H62C | C6 | C5 | H52C | 51.5° | 52.5° |
| H8 | N8 | C9 | H9 | 135.9° | 145.0° |
| H9 | C9 | C27 | H271 | 174.9° | 175.0° |
| H9 | C9 | C27 | H272 | 65.2° | 64.9° |
| H271 | C27 | C31 | H31 | 87.0° | 65.0° |
| H272 | C27 | C31 | H31 | 153.2° | 175.0° |
| H31 | C31 | C33 | H331 | 62.0° | 180.0° |
| H31 | C31 | C33 | H332 | 58.0° | 60.1° |
| H31 | C31 | C33 | H333 | 178.1° | 59.9° |
| H31 | C31 | C32 | H321 | 62.7° | 60.0° |
| H31 | C31 | C32 | H322 | 177.4° | 60.1° |
| H31 | C31 | C32 | H323 | 57.4° | 180.0° |
| H331 | C33 | H332 | H333 | 120.0° | 120.0° |
| H321 | C32 | H322 | H323 | 120.0° | 120.1° |
| H11 | N11 | C12 | H12 | 178.1° | 145.0° |
| H12 | C12 | C13 | H131 | 172.9° | 175.0° |
| H12 | C12 | C13 | H132 | 67.3° | 64.9° |
| H131 | C13 | C14 | H141 | 59.9° | 60.0° |
| H131 | C13 | C14 | H142 | 179.9° | 179.9° |
| H131 | C13 | C14 | H143 | 60.1° | 60.0° |
| H132 | C13 | C14 | H141 | 59.9° | 60.0° |
| H132 | C13 | C14 | H142 | 60.1° | 60.0° |
| H132 | C13 | C14 | H143 | 179.9° | NaN° |
| H141 | C14 | H142 | H143 | 119.9° | 120.0° |
| H22 | C22 | C23 | H23 | 1.3° | 0.0° |
| H26 | C26 | C25 | H25 | 0.9° | 0.0° |
| H23 | C23 | C24 | H24 | 0.4° | 0.1° |
| H24 | C24 | C25 | H25 | 0.6° | 0.0° |
