9PE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O12 | P | doub | 1.48Å | 1.50Å | |
| P | O11 | sing | 1.61Å | 1.55Å | |
| P | O14 | sing | 1.61Å | 1.52Å | |
| P | O13 | sing | 1.61Å | 1.57Å | |
| C12 | N | sing | 1.47Å | 1.50Å | |
| N | HN | sing | 1.01Å | 1.00Å | |
| N | HNA | sing | 1.01Å | 1.00Å | |
| O11 | C1 | sing | 1.43Å | 1.40Å | |
| O13 | C11 | sing | 1.43Å | 1.45Å | |
| O14 | HO14 | sing | 0.97Å | 0.95Å | |
| C11 | C12 | sing | 1.53Å | 1.56Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| O21 | C2 | sing | 1.45Å | 1.43Å | |
| C2 | C3 | sing | 1.53Å | 1.56Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O31 | C3 | sing | 1.45Å | 1.44Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| O31 | C31 | sing | 1.34Å | 1.33Å | |
| C31 | O32 | doub | 1.21Å | 1.19Å | |
| C32 | C31 | sing | 1.51Å | 1.52Å | |
| C33 | C32 | sing | 1.53Å | 1.52Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C35 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C37 | C36 | sing | 1.53Å | 1.53Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| C37 | H37B | sing | 1.09Å | 1.10Å | |
| C21 | O21 | sing | 1.34Å | 1.37Å | |
| O22 | C21 | doub | 1.21Å | 1.24Å | |
| C22 | C21 | sing | 1.51Å | 1.53Å | |
| C23 | C22 | sing | 1.53Å | 1.55Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C27 | C26 | sing | 1.53Å | 1.55Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C28 | C27 | sing | 1.53Å | 1.54Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C28 | C29 | sing | 1.53Å | 1.55Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C2A | C29 | sing | 1.53Å | 1.55Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C2A | C2B | sing | 1.53Å | 1.55Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| C2A | H2AA | sing | 1.09Å | 1.10Å | |
| C2C | C2B | sing | 1.53Å | 1.55Å | |
| C2B | H2B | sing | 1.09Å | 1.10Å | |
| C2B | H2BA | sing | 1.09Å | 1.10Å | |
| C2C | C2D | sing | 1.53Å | 1.53Å | |
| C2C | H2C | sing | 1.09Å | 1.10Å | |
| C2C | H2CA | sing | 1.09Å | 1.10Å | |
| C2E | C2D | sing | 1.53Å | 1.54Å | |
| C2D | H2D | sing | 1.09Å | 1.10Å | |
| C2D | H2DA | sing | 1.09Å | 1.10Å | |
| C2E | C2F | sing | 1.53Å | 1.54Å | |
| C2E | H2E | sing | 1.09Å | 1.10Å | |
| C2E | H2EA | sing | 1.09Å | 1.10Å | |
| C2G | C2F | sing | 1.53Å | 1.54Å | |
| C2F | H2F | sing | 1.09Å | 1.10Å | |
| C2F | H2FA | sing | 1.09Å | 1.10Å | |
| C2H | C2G | sing | 1.53Å | 1.54Å | |
| C2G | H2G | sing | 1.09Å | 1.10Å | |
| C2G | H2GA | sing | 1.09Å | 1.10Å | |
| C2I | C2H | sing | 1.53Å | 1.55Å | |
| C2H | H2H | sing | 1.09Å | 1.10Å | |
| C2H | H2HA | sing | 1.09Å | 1.10Å | |
| C2I | H2I | sing | 1.09Å | 1.10Å | |
| C2I | H2IA | sing | 1.09Å | 1.10Å | |
| C2I | H2IB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O12 | P | O11 | 107.7° | 109.5° |
| O12 | P | O14 | 107.3° | 109.5° |
| O12 | P | O13 | 108.9° | 109.5° |
| O11 | P | O14 | 110.5° | 109.4° |
| O11 | P | O13 | 111.2° | 109.5° |
| P | O11 | C1 | 119.9° | 123.0° |
| O14 | P | O13 | 111.0° | 109.5° |
| P | O14 | HO14 | 109.5° | 114.0° |
| P | O13 | C11 | 117.9° | 123.0° |
| C12 | N | HN | 109.5° | 111.0° |
| C12 | N | HNA | 109.5° | 111.0° |
| N | C12 | C11 | 109.5° | 109.5° |
| N | C12 | H12 | 109.4° | 109.5° |
| N | C12 | H12A | 109.4° | 109.5° |
| HN | N | HNA | 109.5° | 111.0° |
| O11 | C1 | C2 | 105.4° | 109.5° |
| O11 | C1 | H1 | 110.8° | 109.4° |
| O11 | C1 | H1A | 111.7° | 109.5° |
| O13 | C11 | C12 | 115.1° | 109.4° |
| O13 | C11 | H11 | 107.6° | 109.5° |
| O13 | C11 | H11A | 106.3° | 109.5° |
| C12 | C11 | H11 | 107.7° | 109.4° |
| C12 | C11 | H11A | 106.3° | 109.5° |
| C11 | C12 | H12 | 109.4° | 109.5° |
| C11 | C12 | H12A | 109.4° | 109.4° |
| H11 | C11 | H11A | 114.0° | 109.5° |
| H12 | C12 | H12A | 109.5° | 109.5° |
| C2 | C1 | H1 | 110.9° | 109.5° |
| C2 | C1 | H1A | 111.7° | 109.5° |
| C1 | C2 | O21 | 108.4° | 109.5° |
| C1 | C2 | C3 | 114.0° | 109.5° |
| C1 | C2 | H2 | 107.2° | 109.5° |
| H1 | C1 | H1A | 106.4° | 109.5° |
| O21 | C2 | C3 | 109.9° | 109.5° |
| O21 | C2 | H2 | 111.6° | 109.4° |
| C2 | O21 | C21 | 108.5° | 117.0° |
| C3 | C2 | H2 | 105.7° | 109.5° |
| C2 | C3 | O31 | 106.2° | 109.5° |
| C2 | C3 | H3 | 110.6° | 109.5° |
| C2 | C3 | H3A | 111.3° | 109.5° |
| O31 | C3 | H3 | 110.6° | 109.5° |
| O31 | C3 | H3A | 111.3° | 109.4° |
| C3 | O31 | C31 | 115.9° | 117.0° |
| H3 | C3 | H3A | 106.9° | 109.5° |
| O31 | C31 | O32 | 126.9° | 120.1° |
| O31 | C31 | C32 | 111.0° | 120.0° |
| O32 | C31 | C32 | 122.2° | 119.9° |
| C31 | C32 | C33 | 117.5° | 109.5° |
| C31 | C32 | H32 | 106.9° | 109.5° |
| C31 | C32 | H32A | 105.0° | 109.5° |
| C33 | C32 | H32 | 106.9° | 109.5° |
| C33 | C32 | H32A | 105.0° | 109.5° |
| C32 | C33 | C34 | 108.2° | 109.5° |
| C32 | C33 | H33 | 109.9° | 109.5° |
| C32 | C33 | H33A | 110.2° | 109.5° |
| H32 | C32 | H32A | 116.0° | 109.4° |
| C34 | C33 | H33 | 109.9° | 109.4° |
| C34 | C33 | H33A | 110.2° | 109.5° |
| C33 | C34 | C35 | 113.8° | 109.4° |
| C33 | C34 | H34 | 108.0° | 109.4° |
| C33 | C34 | H34A | 107.1° | 109.5° |
| H33 | C33 | H33A | 108.5° | 109.5° |
| C35 | C34 | H34 | 108.1° | 109.5° |
| C35 | C34 | H34A | 107.1° | 109.5° |
| C34 | C35 | C36 | 109.0° | 109.4° |
| C34 | C35 | H35 | 109.6° | 109.5° |
| C34 | C35 | H35A | 109.8° | 109.5° |
| H34 | C34 | H34A | 112.8° | 109.5° |
| C36 | C35 | H35 | 109.7° | 109.5° |
| C36 | C35 | H35A | 109.8° | 109.5° |
| C35 | C36 | C37 | 113.2° | 109.5° |
| C35 | C36 | H36 | 108.3° | 109.5° |
| C35 | C36 | H36A | 107.4° | 109.4° |
| H35 | C35 | H35A | 109.0° | 109.5° |
| C37 | C36 | H36 | 108.2° | 109.5° |
| C37 | C36 | H36A | 107.4° | 109.5° |
| C36 | C37 | H37 | 109.5° | 109.5° |
| C36 | C37 | H37A | 109.5° | 109.5° |
| C36 | C37 | H37B | 109.4° | 109.5° |
| H36 | C36 | H36A | 112.5° | 109.5° |
| H37 | C37 | H37A | 109.4° | 109.5° |
| H37 | C37 | H37B | 109.5° | 109.4° |
| H37A | C37 | H37B | 109.5° | 109.5° |
| O21 | C21 | O22 | 126.7° | 120.0° |
| O21 | C21 | C22 | 110.7° | 120.0° |
| O22 | C21 | C22 | 122.7° | 120.0° |
| C21 | C22 | C23 | 112.5° | 109.5° |
| C21 | C22 | H22 | 108.5° | 109.5° |
| C21 | C22 | H22A | 107.8° | 109.5° |
| C23 | C22 | H22 | 108.5° | 109.5° |
| C23 | C22 | H22A | 107.8° | 109.5° |
| C22 | C23 | C24 | 109.4° | 109.5° |
| C22 | C23 | H23 | 109.5° | 109.5° |
| C22 | C23 | H23A | 109.5° | 109.5° |
| H22 | C22 | H22A | 111.8° | 109.5° |
| C24 | C23 | H23 | 109.5° | 109.4° |
| C24 | C23 | H23A | 109.5° | 109.5° |
| C23 | C24 | C25 | 111.1° | 109.5° |
| C23 | C24 | H24 | 109.0° | 109.4° |
| C23 | C24 | H24A | 108.6° | 109.5° |
| H23 | C23 | H23A | 109.4° | 109.4° |
| C25 | C24 | H24 | 108.9° | 109.4° |
| C25 | C24 | H24A | 108.6° | 109.5° |
| C24 | C25 | C26 | 108.5° | 109.5° |
| C24 | C25 | H25 | 109.8° | 109.4° |
| C24 | C25 | H25A | 110.0° | 109.4° |
| H24 | C24 | H24A | 110.7° | 109.4° |
| C26 | C25 | H25 | 109.8° | 109.5° |
| C26 | C25 | H25A | 110.0° | 109.5° |
| C25 | C26 | C27 | 113.0° | 109.5° |
| C25 | C26 | H26 | 108.3° | 109.4° |
| C25 | C26 | H26A | 107.5° | 109.4° |
| H25 | C25 | H25A | 108.8° | 109.5° |
| C27 | C26 | H26 | 108.3° | 109.5° |
| C27 | C26 | H26A | 107.5° | 109.5° |
| C26 | C27 | C28 | 117.3° | 109.5° |
| C26 | C27 | H27 | 107.0° | 109.5° |
| C26 | C27 | H27A | 105.1° | 109.5° |
| H26 | C26 | H26A | 112.3° | 109.5° |
| C28 | C27 | H27 | 106.9° | 109.5° |
| C28 | C27 | H27A | 105.1° | 109.5° |
| C27 | C28 | C29 | 105.6° | 109.5° |
| C27 | C28 | H28 | 110.8° | 109.5° |
| C27 | C28 | H28A | 111.6° | 109.5° |
| H27 | C27 | H27A | 115.9° | 109.4° |
| C29 | C28 | H28 | 110.8° | 109.5° |
| C29 | C28 | H28A | 111.6° | 109.5° |
| C28 | C29 | C2A | 115.1° | 109.5° |
| C28 | C29 | H29 | 107.6° | 109.5° |
| C28 | C29 | H29A | 106.3° | 109.5° |
| H28 | C28 | H28A | 106.5° | 109.4° |
| C2A | C29 | H29 | 107.6° | 109.4° |
| C2A | C29 | H29A | 106.3° | 109.4° |
| C29 | C2A | C2B | 110.5° | 109.5° |
| C29 | C2A | H2A | 109.1° | 109.5° |
| C29 | C2A | H2AA | 108.9° | 109.5° |
| H29 | C29 | H29A | 114.0° | 109.5° |
| C2B | C2A | H2A | 109.1° | 109.4° |
| C2B | C2A | H2AA | 108.9° | 109.4° |
| C2A | C2B | C2C | 107.1° | 109.5° |
| C2A | C2B | H2B | 110.3° | 109.4° |
| C2A | C2B | H2BA | 110.8° | 109.5° |
| H2A | C2A | H2AA | 110.2° | 109.5° |
| C2C | C2B | H2B | 110.3° | 109.5° |
| C2C | C2B | H2BA | 110.8° | 109.5° |
| C2B | C2C | C2D | 110.6° | 109.5° |
| C2B | C2C | H2C | 109.1° | 109.5° |
| C2B | C2C | H2CA | 108.9° | 109.5° |
| H2B | C2B | H2BA | 107.6° | 109.4° |
| C2D | C2C | H2C | 109.1° | 109.5° |
| C2D | C2C | H2CA | 108.9° | 109.5° |
| C2C | C2D | C2E | 111.2° | 109.5° |
| C2C | C2D | H2D | 108.9° | 109.4° |
| C2C | C2D | H2DA | 108.5° | 109.5° |
| H2C | C2C | H2CA | 110.3° | 109.4° |
| C2E | C2D | H2D | 108.9° | 109.5° |
| C2E | C2D | H2DA | 108.5° | 109.4° |
| C2D | C2E | C2F | 108.7° | 109.5° |
| C2D | C2E | H2E | 109.7° | 109.5° |
| C2D | C2E | H2EA | 109.9° | 109.4° |
| H2D | C2D | H2DA | 110.8° | 109.5° |
| C2F | C2E | H2E | 109.7° | 109.5° |
| C2F | C2E | H2EA | 109.9° | 109.5° |
| C2E | C2F | C2G | 112.5° | 109.5° |
| C2E | C2F | H2F | 108.5° | 109.5° |
| C2E | C2F | H2FA | 107.8° | 109.5° |
| H2E | C2E | H2EA | 108.9° | 109.5° |
| C2G | C2F | H2F | 108.5° | 109.5° |
| C2G | C2F | H2FA | 107.8° | 109.4° |
| C2F | C2G | C2H | 109.9° | 109.5° |
| C2F | C2G | H2G | 109.3° | 109.5° |
| C2F | C2G | H2GA | 109.3° | 109.5° |
| H2F | C2F | H2FA | 111.8° | 109.4° |
| C2H | C2G | H2G | 109.3° | 109.5° |
| C2H | C2G | H2GA | 109.3° | 109.4° |
| C2G | C2H | C2I | 110.2° | 109.5° |
| C2G | C2H | H2H | 109.2° | 109.5° |
| C2G | C2H | H2HA | 109.0° | 109.4° |
| H2G | C2G | H2GA | 109.8° | 109.5° |
| C2I | C2H | H2H | 109.2° | 109.5° |
| C2I | C2H | H2HA | 109.1° | 109.5° |
| C2H | C2I | H2I | 109.5° | 109.5° |
| C2H | C2I | H2IA | 109.5° | 109.5° |
| C2H | C2I | H2IB | 109.4° | 109.5° |
| H2H | C2H | H2HA | 110.1° | 109.4° |
| H2I | C2I | H2IA | 109.5° | 109.5° |
| H2I | C2I | H2IB | 109.5° | 109.4° |
| H2IA | C2I | H2IB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O12 | P | O11 | O14 | 117.0° | 120.0° |
| O12 | P | O11 | O13 | 119.3° | 120.0° |
| O12 | P | O14 | O13 | 118.9° | 120.0° |
| O12 | P | O11 | C1 | 117.5° | 54.9° |
| O12 | P | O13 | C11 | 178.8° | 55.0° |
| O12 | P | O14 | HO14 | 160.1° | 179.9° |
| O11 | P | O14 | O13 | 123.9° | 120.0° |
| O11 | P | O13 | C11 | 60.2° | 175.0° |
| O11 | P | O14 | HO14 | 82.7° | 59.9° |
| P | O11 | C1 | C2 | 163.2° | 180.0° |
| P | O11 | C1 | H1 | 76.8° | 60.1° |
| P | O11 | C1 | H1A | 41.7° | 59.9° |
| O14 | P | O11 | C1 | 0.5° | 65.1° |
| O14 | P | O13 | C11 | 63.2° | 65.0° |
| O13 | P | O11 | C1 | 123.2° | 175.0° |
| O13 | P | O14 | HO14 | 41.2° | 60.1° |
| P | O13 | C11 | C12 | 134.5° | 180.0° |
| P | O13 | C11 | H11 | 14.5° | 60.1° |
| P | O13 | C11 | H11A | 108.1° | 60.0° |
| C12 | N | HN | HNA | 120.0° | 124.0° |
| N | C12 | C11 | O13 | 95.5° | 65.0° |
| N | C12 | C11 | H12 | 120.0° | 120.0° |
| N | C12 | C11 | H12A | 120.0° | 120.0° |
| N | C12 | C11 | H11 | 144.5° | 55.0° |
| N | C12 | C11 | H11A | 21.9° | 175.0° |
| N | C12 | H12 | H12A | 120.0° | 120.0° |
| HN | N | C12 | C11 | 56.9° | 56.1° |
| HN | N | C12 | H12 | 176.9° | 176.1° |
| HN | N | C12 | H12A | 63.0° | 63.9° |
| HNA | N | C12 | C11 | 177.0° | 180.0° |
| HNA | N | C12 | H12 | 63.1° | 60.0° |
| HNA | N | C12 | H12A | 57.0° | 60.1° |
| O11 | C1 | C2 | H1 | 120.0° | 119.9° |
| O11 | C1 | C2 | H1A | 121.5° | 120.0° |
| O11 | C1 | H1 | H1A | 121.6° | 120.0° |
| O11 | C1 | C2 | O21 | 121.4° | 65.0° |
| O11 | C1 | C2 | C3 | 115.8° | 55.0° |
| O11 | C1 | C2 | H2 | 0.8° | 175.0° |
| O13 | C11 | C12 | H11 | 120.0° | 120.0° |
| O13 | C11 | C12 | H11A | 117.4° | 120.0° |
| O13 | C11 | H11 | H11A | 117.6° | 120.1° |
| O13 | C11 | C12 | H12 | 144.5° | 55.0° |
| O13 | C11 | C12 | H12A | 24.5° | 175.0° |
| C12 | C11 | H11 | H11A | 117.7° | 120.0° |
| C11 | C12 | H12 | H12A | 120.0° | 120.0° |
| H11 | C11 | C12 | H12 | 24.5° | 175.0° |
| H11 | C11 | C12 | H12A | 95.5° | 65.0° |
| H11A | C11 | C12 | H12 | 98.1° | 65.0° |
| H11A | C11 | C12 | H12A | 141.9° | 55.0° |
| C2 | C1 | H1 | H1A | 121.7° | 120.0° |
| C1 | C2 | O21 | C3 | 125.2° | 120.0° |
| C1 | C2 | O21 | H2 | 117.9° | 120.0° |
| C1 | C2 | C3 | H2 | 117.5° | 120.0° |
| C1 | C2 | C3 | O31 | 179.8° | 55.0° |
| C1 | C2 | C3 | H3 | 59.8° | 175.0° |
| C1 | C2 | C3 | H3A | 58.8° | 65.0° |
| C1 | C2 | O21 | C21 | 122.1° | 90.0° |
| H1 | C1 | C2 | O21 | 118.6° | 55.0° |
| H1 | C1 | C2 | C3 | 4.1° | 175.0° |
| H1 | C1 | C2 | H2 | 120.8° | 65.0° |
| H1A | C1 | C2 | O21 | 0.1° | 175.0° |
| H1A | C1 | C2 | C3 | 122.6° | 65.0° |
| H1A | C1 | C2 | H2 | 120.7° | 55.0° |
| O21 | C2 | C3 | H2 | 120.6° | 120.0° |
| O21 | C2 | C3 | O31 | 58.2° | 65.1° |
| O21 | C2 | C3 | H3 | 178.2° | 55.0° |
| O21 | C2 | C3 | H3A | 63.1° | 175.0° |
| C2 | O21 | C21 | O22 | 0.5° | 0.0° |
| C2 | O21 | C21 | C22 | 179.3° | 179.9° |
| C2 | C3 | O31 | H3 | 120.0° | 120.0° |
| C2 | C3 | O31 | H3A | 121.3° | 120.0° |
| C2 | C3 | H3 | H3A | 121.3° | 120.0° |
| C2 | C3 | O31 | C31 | 178.8° | 180.0° |
| C3 | C2 | O21 | C21 | 112.7° | 150.0° |
| H2 | C2 | C3 | O31 | 62.3° | 175.0° |
| H2 | C2 | C3 | H3 | 57.7° | 65.0° |
| H2 | C2 | C3 | H3A | 176.4° | 55.0° |
| H2 | C2 | O21 | C21 | 4.2° | 30.0° |
| O31 | C3 | H3 | H3A | 121.4° | 119.9° |
| C3 | O31 | C31 | O32 | 0.2° | 0.0° |
| C3 | O31 | C31 | C32 | 180.0° | 180.0° |
| H3 | C3 | O31 | C31 | 58.8° | 59.9° |
| H3A | C3 | O31 | C31 | 59.9° | 60.0° |
| O31 | C31 | O32 | C32 | 179.7° | 180.0° |
| O31 | C31 | C32 | C33 | 9.5° | 180.0° |
| O31 | C31 | C32 | H32 | 129.4° | 60.0° |
| O31 | C31 | C32 | H32A | 106.8° | 60.0° |
| O32 | C31 | C32 | C33 | 170.3° | 0.1° |
| O32 | C31 | C32 | H32 | 50.3° | 120.1° |
| O32 | C31 | C32 | H32A | 73.4° | 120.0° |
| C31 | C32 | C33 | H32 | 120.0° | 120.0° |
| C31 | C32 | C33 | H32A | 116.3° | 120.0° |
| C31 | C32 | H32 | H32A | 116.7° | 120.0° |
| C31 | C32 | C33 | C34 | 178.4° | 180.0° |
| C31 | C32 | C33 | H33 | 58.4° | 60.1° |
| C31 | C32 | C33 | H33A | 61.1° | 60.0° |
| C33 | C32 | H32 | H32A | 116.7° | 120.0° |
| C32 | C33 | C34 | H33 | 120.0° | 120.0° |
| C32 | C33 | C34 | H33A | 120.5° | 120.0° |
| C32 | C33 | H33 | H33A | 120.6° | 120.1° |
| C32 | C33 | C34 | C35 | 156.5° | 180.0° |
| C32 | C33 | C34 | H34 | 83.5° | 60.0° |
| C32 | C33 | C34 | H34A | 38.3° | 60.0° |
| H32 | C32 | C33 | C34 | 61.6° | 60.0° |
| H32 | C32 | C33 | H33 | 178.4° | 180.0° |
| H32 | C32 | C33 | H33A | 58.9° | 60.0° |
| H32A | C32 | C33 | C34 | 62.1° | 60.0° |
| H32A | C32 | C33 | H33 | 57.9° | 60.0° |
| H32A | C32 | C33 | H33A | 177.4° | 180.0° |
| C34 | C33 | H33 | H33A | 120.5° | 120.0° |
| C33 | C34 | C35 | H34 | 120.0° | 119.9° |
| C33 | C34 | C35 | H34A | 118.1° | 120.0° |
| C33 | C34 | H34 | H34A | 118.2° | 120.0° |
| C33 | C34 | C35 | C36 | 179.8° | 180.0° |
| C33 | C34 | C35 | H35 | 60.1° | 60.1° |
| C33 | C34 | C35 | H35A | 59.6° | 60.0° |
| H33 | C33 | C34 | C35 | 36.5° | 60.0° |
| H33 | C33 | C34 | H34 | 156.5° | 180.0° |
| H33 | C33 | C34 | H34A | 81.7° | 60.0° |
| H33A | C33 | C34 | C35 | 83.0° | 60.0° |
| H33A | C33 | C34 | H34 | 37.0° | 60.0° |
| H33A | C33 | C34 | H34A | 158.8° | 180.0° |
| C35 | C34 | H34 | H34A | 118.3° | 120.0° |
| C34 | C35 | C36 | H35 | 120.0° | 120.0° |
| C34 | C35 | C36 | H35A | 120.2° | 120.0° |
| C34 | C35 | H35 | H35A | 120.2° | 120.0° |
| C34 | C35 | C36 | C37 | 170.1° | 180.0° |
| C34 | C35 | C36 | H36 | 69.9° | 60.0° |
| C34 | C35 | C36 | H36A | 51.7° | 60.0° |
| H34 | C34 | C35 | C36 | 59.8° | 60.0° |
| H34 | C34 | C35 | H35 | 179.9° | 180.0° |
| H34 | C34 | C35 | H35A | 60.4° | 60.0° |
| H34A | C34 | C35 | C36 | 62.0° | 60.0° |
| H34A | C34 | C35 | H35 | 58.0° | 60.0° |
| H34A | C34 | C35 | H35A | 177.8° | 180.0° |
| C36 | C35 | H35 | H35A | 120.2° | 120.0° |
| C35 | C36 | C37 | H36 | 120.0° | 120.0° |
| C35 | C36 | C37 | H36A | 118.4° | 120.0° |
| C35 | C36 | H36 | H36A | 118.5° | 120.0° |
| C35 | C36 | C37 | H37 | 21.1° | 60.0° |
| C35 | C36 | C37 | H37A | 141.1° | 180.0° |
| C35 | C36 | C37 | H37B | 98.9° | 60.0° |
| H35 | C35 | C36 | C37 | 50.1° | 60.0° |
| H35 | C35 | C36 | H36 | 170.1° | 180.0° |
| H35 | C35 | C36 | H36A | 68.3° | 60.0° |
| H35A | C35 | C36 | C37 | 69.7° | 60.0° |
| H35A | C35 | C36 | H36 | 50.3° | 60.0° |
| H35A | C35 | C36 | H36A | 172.0° | 180.0° |
| C37 | C36 | H36 | H36A | 118.5° | 120.0° |
| C36 | C37 | H37 | H37A | 120.0° | 120.0° |
| C36 | C37 | H37 | H37B | 120.0° | 120.0° |
| C36 | C37 | H37A | H37B | 120.0° | 120.0° |
| H36 | C36 | C37 | H37 | 98.9° | 60.0° |
| H36 | C36 | C37 | H37A | 21.1° | 60.0° |
| H36 | C36 | C37 | H37B | 141.0° | 180.0° |
| H36A | C36 | C37 | H37 | 139.4° | 180.0° |
| H36A | C36 | C37 | H37A | 100.6° | 60.0° |
| H36A | C36 | C37 | H37B | 19.4° | 60.0° |
| H37 | C37 | H37A | H37B | 120.0° | 120.0° |
| O21 | C21 | O22 | C22 | 179.7° | 180.0° |
| O21 | C21 | C22 | C23 | 179.6° | 180.0° |
| O21 | C21 | C22 | H22 | 60.4° | 60.0° |
| O21 | C21 | C22 | H22A | 60.8° | 60.0° |
| O22 | C21 | C22 | C23 | 0.2° | 0.0° |
| O22 | C21 | C22 | H22 | 119.8° | 120.0° |
| O22 | C21 | C22 | H22A | 119.0° | 119.9° |
| C21 | C22 | C23 | H22 | 120.0° | 120.0° |
| C21 | C22 | C23 | H22A | 118.7° | 120.0° |
| C21 | C22 | H22 | H22A | 118.7° | 120.0° |
| C21 | C22 | C23 | C24 | 92.6° | 180.0° |
| C21 | C22 | C23 | H23 | 147.4° | 60.0° |
| C21 | C22 | C23 | H23A | 27.4° | 60.0° |
| C23 | C22 | H22 | H22A | 118.8° | 120.0° |
| C22 | C23 | C24 | H23 | 120.0° | 120.0° |
| C22 | C23 | C24 | H23A | 120.0° | 120.1° |
| C22 | C23 | H23 | H23A | 120.0° | 120.1° |
| C22 | C23 | C24 | C25 | 134.0° | 180.0° |
| C22 | C23 | C24 | H24 | 106.0° | 60.0° |
| C22 | C23 | C24 | H24A | 14.7° | 60.0° |
| H22 | C22 | C23 | C24 | 27.4° | 60.0° |
| H22 | C22 | C23 | H23 | 92.6° | 180.0° |
| H22 | C22 | C23 | H23A | 147.4° | 60.0° |
| H22A | C22 | C23 | C24 | 148.7° | 60.0° |
| H22A | C22 | C23 | H23 | 28.7° | 60.0° |
| H22A | C22 | C23 | H23A | 91.3° | 180.0° |
| C24 | C23 | H23 | H23A | 120.0° | 119.9° |
| C23 | C24 | C25 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H24A | 119.3° | 120.1° |
| C23 | C24 | H24 | H24A | 119.4° | 120.0° |
| C23 | C24 | C25 | C26 | 83.7° | 179.9° |
| C23 | C24 | C25 | H25 | 156.3° | 60.0° |
| C23 | C24 | C25 | H25A | 36.7° | 60.0° |
| H23 | C23 | C24 | C25 | 14.0° | 60.0° |
| H23 | C23 | C24 | H24 | 134.0° | 180.0° |
| H23 | C23 | C24 | H24A | 105.3° | 60.1° |
| H23A | C23 | C24 | C25 | 106.0° | 59.9° |
| H23A | C23 | C24 | H24 | 14.0° | 60.1° |
| H23A | C23 | C24 | H24A | 134.7° | 180.0° |
| C25 | C24 | H24 | H24A | 119.3° | 120.0° |
| C24 | C25 | C26 | H25 | 120.0° | 120.0° |
| C24 | C25 | C26 | H25A | 120.4° | 120.0° |
| C24 | C25 | H25 | H25A | 120.4° | 120.0° |
| C24 | C25 | C26 | C27 | 145.2° | 180.0° |
| C24 | C25 | C26 | H26 | 94.8° | 60.0° |
| C24 | C25 | C26 | H26A | 26.7° | 60.0° |
| H24 | C24 | C25 | C26 | 36.3° | 60.0° |
| H24 | C24 | C25 | H25 | 83.7° | 180.0° |
| H24 | C24 | C25 | H25A | 156.7° | 60.0° |
| H24A | C24 | C25 | C26 | 157.0° | 60.0° |
| H24A | C24 | C25 | H25 | 37.0° | 60.1° |
| H24A | C24 | C25 | H25A | 82.6° | 180.0° |
| C26 | C25 | H25 | H25A | 120.4° | 120.0° |
| C25 | C26 | C27 | H26 | 120.0° | 120.0° |
| C25 | C26 | C27 | H26A | 118.5° | 119.9° |
| C25 | C26 | H26 | H26A | 118.6° | 119.9° |
| C25 | C26 | C27 | C28 | 156.1° | 180.0° |
| C25 | C26 | C27 | H27 | 84.0° | 59.9° |
| C25 | C26 | C27 | H27A | 39.7° | 60.0° |
| H25 | C25 | C26 | C27 | 25.2° | 60.0° |
| H25 | C25 | C26 | H26 | 145.2° | 180.0° |
| H25 | C25 | C26 | H26A | 93.3° | 60.0° |
| H25A | C25 | C26 | C27 | 94.4° | 60.1° |
| H25A | C25 | C26 | H26 | 25.5° | 60.0° |
| H25A | C25 | C26 | H26A | 147.1° | 180.0° |
| C27 | C26 | H26 | H26A | 118.5° | 120.0° |
| C26 | C27 | C28 | H27 | 120.0° | 120.1° |
| C26 | C27 | C28 | H27A | 116.3° | 120.0° |
| C26 | C27 | H27 | H27A | 116.8° | 120.0° |
| C26 | C27 | C28 | C29 | 96.9° | 180.0° |
| C26 | C27 | C28 | H28 | 143.1° | 60.0° |
| C26 | C27 | C28 | H28A | 24.6° | 60.0° |
| H26 | C26 | C27 | C28 | 36.1° | 60.0° |
| H26 | C26 | C27 | H27 | 156.0° | 179.9° |
| H26 | C26 | C27 | H27A | 80.3° | 60.0° |
| H26A | C26 | C27 | C28 | 85.5° | 60.0° |
| H26A | C26 | C27 | H27 | 34.5° | 60.0° |
| H26A | C26 | C27 | H27A | 158.2° | 180.0° |
| C28 | C27 | H27 | H27A | 116.8° | 119.9° |
| C27 | C28 | C29 | H28 | 120.0° | 120.0° |
| C27 | C28 | C29 | H28A | 121.5° | 120.0° |
| C27 | C28 | H28 | H28A | 121.6° | 120.0° |
| C27 | C28 | C29 | C2A | 169.0° | 180.0° |
| C27 | C28 | C29 | H29 | 49.0° | 60.0° |
| C27 | C28 | C29 | H29A | 73.5° | 60.0° |
| H27 | C27 | C28 | C29 | 23.1° | 60.0° |
| H27 | C27 | C28 | H28 | 96.9° | 180.0° |
| H27 | C27 | C28 | H28A | 144.6° | 60.1° |
| H27A | C27 | C28 | C29 | 146.8° | 59.9° |
| H27A | C27 | C28 | H28 | 26.8° | 60.1° |
| H27A | C27 | C28 | H28A | 91.7° | 180.0° |
| C29 | C28 | H28 | H28A | 121.6° | 120.0° |
| C28 | C29 | C2A | H29 | 120.0° | 120.0° |
| C28 | C29 | C2A | H29A | 117.5° | 120.0° |
| C28 | C29 | H29 | H29A | 117.7° | 120.1° |
| C28 | C29 | C2A | C2B | 130.3° | 180.0° |
| C28 | C29 | C2A | H2A | 109.7° | 60.0° |
| C28 | C29 | C2A | H2AA | 10.7° | 60.0° |
| H28 | C28 | C29 | C2A | 71.0° | 60.0° |
| H28 | C28 | C29 | H29 | 169.0° | 180.0° |
| H28 | C28 | C29 | H29A | 46.5° | 60.0° |
| H28A | C28 | C29 | C2A | 47.5° | 60.0° |
| H28A | C28 | C29 | H29 | 72.5° | 60.0° |
| H28A | C28 | C29 | H29A | 165.0° | 180.0° |
| C2A | C29 | H29 | H29A | 117.6° | 120.0° |
| C29 | C2A | C2B | H2A | 120.0° | 120.0° |
| C29 | C2A | C2B | H2AA | 119.6° | 120.0° |
| C29 | C2A | H2A | H2AA | 119.6° | 120.0° |
| C29 | C2A | C2B | C2C | 138.9° | 180.0° |
| C29 | C2A | C2B | H2B | 101.1° | 60.0° |
| C29 | C2A | C2B | H2BA | 18.0° | 59.9° |
| H29 | C29 | C2A | C2B | 10.2° | 60.0° |
| H29 | C29 | C2A | H2A | 130.2° | 180.0° |
| H29 | C29 | C2A | H2AA | 109.4° | 60.0° |
| H29A | C29 | C2A | C2B | 112.3° | 60.0° |
| H29A | C29 | C2A | H2A | 7.7° | 60.0° |
| H29A | C29 | C2A | H2AA | 128.1° | 180.0° |
| C2B | C2A | H2A | H2AA | 119.6° | 120.0° |
| C2A | C2B | C2C | H2B | 120.0° | 120.0° |
| C2A | C2B | C2C | H2BA | 120.9° | 120.0° |
| C2A | C2B | H2B | H2BA | 120.9° | 120.0° |
| C2A | C2B | C2C | C2D | 140.4° | 180.0° |
| C2A | C2B | C2C | H2C | 20.4° | 60.0° |
| C2A | C2B | C2C | H2CA | 100.0° | 60.0° |
| H2A | C2A | C2B | C2C | 18.9° | 60.0° |
| H2A | C2A | C2B | H2B | 138.9° | 180.0° |
| H2A | C2A | C2B | H2BA | 102.1° | 60.1° |
| H2AA | C2A | C2B | C2C | 101.5° | 60.0° |
| H2AA | C2A | C2B | H2B | 18.5° | 60.0° |
| H2AA | C2A | C2B | H2BA | 137.5° | 180.0° |
| C2C | C2B | H2B | H2BA | 121.0° | 120.1° |
| C2B | C2C | C2D | H2C | 120.0° | 120.0° |
| C2B | C2C | C2D | H2CA | 119.5° | 120.1° |
| C2B | C2C | H2C | H2CA | 119.6° | 120.1° |
| C2B | C2C | C2D | C2E | 161.8° | 179.9° |
| C2B | C2C | C2D | H2D | 78.3° | 60.0° |
| C2B | C2C | C2D | H2DA | 42.5° | 60.0° |
| H2B | C2B | C2C | C2D | 99.6° | 60.0° |
| H2B | C2B | C2C | H2C | 140.4° | 180.0° |
| H2B | C2B | C2C | H2CA | 20.0° | 60.0° |
| H2BA | C2B | C2C | C2D | 19.5° | 60.0° |
| H2BA | C2B | C2C | H2C | 100.5° | 60.0° |
| H2BA | C2B | C2C | H2CA | 139.0° | NaN° |
| C2D | C2C | H2C | H2CA | 119.6° | 120.0° |
| C2C | C2D | C2E | H2D | 120.0° | 120.0° |
| C2C | C2D | C2E | H2DA | 119.3° | 120.0° |
| C2C | C2D | H2D | H2DA | 119.3° | 120.0° |
| C2C | C2D | C2E | C2F | 108.3° | 180.0° |
| C2C | C2D | C2E | H2E | 11.6° | 60.0° |
| C2C | C2D | C2E | H2EA | 131.4° | 60.0° |
| H2C | C2C | C2D | C2E | 41.8° | 60.0° |
| H2C | C2C | C2D | H2D | 161.7° | 180.0° |
| H2C | C2C | C2D | H2DA | 77.5° | 60.0° |
| H2CA | C2C | C2D | C2E | 78.7° | 60.0° |
| H2CA | C2C | C2D | H2D | 41.3° | 60.1° |
| H2CA | C2C | C2D | H2DA | 162.0° | 179.9° |
| C2E | C2D | H2D | H2DA | 119.3° | 120.0° |
| C2D | C2E | C2F | H2E | 120.0° | 120.0° |
| C2D | C2E | C2F | H2EA | 120.3° | 119.9° |
| C2D | C2E | H2E | H2EA | 120.3° | 120.0° |
| C2D | C2E | C2F | C2G | 179.3° | 180.0° |
| C2D | C2E | C2F | H2F | 60.7° | 60.0° |
| C2D | C2E | C2F | H2FA | 60.6° | 60.0° |
| H2D | C2D | C2E | C2F | 131.7° | 60.0° |
| H2D | C2D | C2E | H2E | 108.4° | 180.0° |
| H2D | C2D | C2E | H2EA | 11.4° | 60.0° |
| H2DA | C2D | C2E | C2F | 10.9° | 60.0° |
| H2DA | C2D | C2E | H2E | 130.9° | 60.0° |
| H2DA | C2D | C2E | H2EA | 109.4° | 180.0° |
| C2F | C2E | H2E | H2EA | 120.3° | 120.0° |
| C2E | C2F | C2G | H2F | 120.0° | 120.0° |
| C2E | C2F | C2G | H2FA | 118.7° | 120.0° |
| C2E | C2F | H2F | H2FA | 118.8° | 120.0° |
| C2E | C2F | C2G | C2H | 105.4° | 180.0° |
| C2E | C2F | C2G | H2G | 14.6° | 60.0° |
| C2E | C2F | C2G | H2GA | 134.8° | 60.1° |
| H2E | C2E | C2F | C2G | 59.3° | 60.0° |
| H2E | C2E | C2F | H2F | 179.3° | 180.0° |
| H2E | C2E | C2F | H2FA | 59.4° | 60.0° |
| H2EA | C2E | C2F | C2G | 60.4° | 60.1° |
| H2EA | C2E | C2F | H2F | 59.6° | 60.0° |
| H2EA | C2E | C2F | H2FA | 179.1° | 180.0° |
| C2G | C2F | H2F | H2FA | 118.8° | 120.0° |
| C2F | C2G | C2H | H2G | 120.0° | 120.0° |
| C2F | C2G | C2H | H2GA | 119.8° | 120.0° |
| C2F | C2G | H2G | H2GA | 119.8° | 120.0° |
| C2F | C2G | C2H | C2I | 176.2° | 180.0° |
| C2F | C2G | C2H | H2H | 63.8° | 59.9° |
| C2F | C2G | C2H | H2HA | 56.5° | 60.0° |
| H2F | C2F | C2G | C2H | 134.6° | 60.0° |
| H2F | C2F | C2G | H2G | 105.4° | 180.0° |
| H2F | C2F | C2G | H2GA | 14.7° | 60.0° |
| H2FA | C2F | C2G | C2H | 13.3° | 60.0° |
| H2FA | C2F | C2G | H2G | 133.3° | 60.0° |
| H2FA | C2F | C2G | H2GA | 106.5° | 179.9° |
| C2H | C2G | H2G | H2GA | 119.9° | 119.9° |
| C2G | C2H | C2I | H2H | 120.0° | 120.1° |
| C2G | C2H | C2I | H2HA | 119.7° | 119.9° |
| C2G | C2H | H2H | H2HA | 119.7° | 119.9° |
| C2G | C2H | C2I | H2I | 136.3° | 60.0° |
| C2G | C2H | C2I | H2IA | 16.3° | 60.1° |
| C2G | C2H | C2I | H2IB | 103.7° | 179.9° |
| H2G | C2G | C2H | C2I | 56.3° | 60.0° |
| H2G | C2G | C2H | H2H | 176.2° | 179.9° |
| H2G | C2G | C2H | H2HA | 63.5° | 60.0° |
| H2GA | C2G | C2H | C2I | 63.9° | 60.0° |
| H2GA | C2G | C2H | H2H | 56.1° | 60.1° |
| H2GA | C2G | C2H | H2HA | 176.4° | 180.0° |
| C2I | C2H | H2H | H2HA | 119.7° | 120.0° |
| C2H | C2I | H2I | H2IA | 120.0° | 120.0° |
| C2H | C2I | H2I | H2IB | 120.0° | 120.0° |
| C2H | C2I | H2IA | H2IB | 120.0° | 120.0° |
| H2H | C2H | C2I | H2I | 103.7° | 180.0° |
| H2H | C2H | C2I | H2IA | 136.2° | 60.0° |
| H2H | C2H | C2I | H2IB | 16.2° | 60.0° |
| H2HA | C2H | C2I | H2I | 16.6° | 60.0° |
| H2HA | C2H | C2I | H2IA | 103.4° | 180.0° |
| H2HA | C2H | C2I | H2IB | 136.6° | 60.0° |
| H2I | C2I | H2IA | H2IB | 120.0° | 120.0° |
