T1C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C94 | C93 | sing | 1.53Å | 1.54Å | |
| C93 | C95 | sing | 1.53Å | 1.54Å | |
| C93 | C96 | sing | 1.53Å | 1.54Å | |
| C93 | N92 | sing | 1.47Å | 1.49Å | |
| N92 | C92 | sing | 1.47Å | 1.49Å | |
| C92 | C91 | sing | 1.51Å | 1.55Å | |
| C91 | O91 | doub | 1.21Å | 1.24Å | |
| C91 | N9 | sing | 1.35Å | 1.34Å | |
| N9 | C9 | sing | 1.40Å | 1.35Å | |
| C9 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | C7 | sing | 1.38Å | 1.42Å | Aromatic |
| C7 | N7 | sing | 1.40Å | 1.37Å | |
| C7 | C61 | doub | 1.38Å | 1.43Å | Aromatic |
| C6 | C61 | sing | 1.51Å | 1.59Å | |
| N7 | C71 | sing | 1.47Å | 1.49Å | |
| N7 | C72 | sing | 1.47Å | 1.52Å | |
| C61 | C1A | sing | 1.40Å | 1.42Å | Aromatic |
| C6 | C51 | sing | 1.53Å | 1.55Å | |
| C51 | C5 | sing | 1.53Å | 1.58Å | |
| C51 | C1B | sing | 1.50Å | 1.52Å | |
| C5 | C41 | sing | 1.53Å | 1.57Å | |
| C41 | C4 | sing | 1.52Å | 1.59Å | |
| C41 | C1C | sing | 1.53Å | 1.50Å | |
| C4 | N4 | sing | 1.47Å | 1.47Å | |
| C4 | C3 | sing | 1.50Å | 1.53Å | |
| N4 | C43 | sing | 1.47Å | 1.47Å | |
| N4 | C42 | sing | 1.47Å | 1.48Å | |
| C3 | O3 | sing | 1.34Å | 1.36Å | |
| C3 | C2 | doub | 1.37Å | 1.39Å | |
| C2 | C21 | sing | 1.47Å | 1.58Å | |
| C2 | C1 | sing | 1.46Å | 1.38Å | |
| C21 | O21 | doub | 1.22Å | 1.23Å | |
| C21 | N21 | sing | 1.35Å | 1.36Å | |
| C1 | O1 | doub | 1.21Å | 1.23Å | |
| C1 | C1C | sing | 1.52Å | 1.52Å | |
| C1C | O1C | sing | 1.43Å | 1.42Å | |
| C1C | C12 | sing | 1.51Å | 1.49Å | |
| C12 | O12 | sing | 1.35Å | 1.34Å | |
| C12 | C1B | doub | 1.34Å | 1.38Å | |
| C1B | C11 | sing | 1.43Å | 1.40Å | |
| C11 | O11 | doub | 1.22Å | 1.23Å | |
| C11 | C1A | sing | 1.48Å | 1.38Å | |
| C1A | C10 | doub | 1.40Å | 1.43Å | Aromatic |
| C10 | O10 | sing | 1.36Å | 1.40Å | |
| C94 | H941 | sing | 1.09Å | 1.10Å | |
| C94 | H942 | sing | 1.09Å | 1.10Å | |
| C94 | H943 | sing | 1.09Å | 1.10Å | |
| C95 | H951 | sing | 1.09Å | 1.10Å | |
| C95 | H952 | sing | 1.09Å | 1.10Å | |
| C95 | H953 | sing | 1.09Å | 1.10Å | |
| C96 | H961 | sing | 1.09Å | 1.10Å | |
| C96 | H962 | sing | 1.09Å | 1.10Å | |
| C96 | H963 | sing | 1.09Å | 1.10Å | |
| N92 | H92 | sing | 1.01Å | 1.00Å | |
| C92 | H921 | sing | 1.09Å | 1.10Å | |
| C92 | H922 | sing | 1.09Å | 1.10Å | |
| N9 | H9 | sing | 0.97Å | 1.00Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C71 | H711 | sing | 1.09Å | 1.10Å | |
| C71 | H712 | sing | 1.09Å | 1.10Å | |
| C71 | H713 | sing | 1.09Å | 1.10Å | |
| C72 | H721 | sing | 1.09Å | 1.10Å | |
| C72 | H722 | sing | 1.09Å | 1.10Å | |
| C72 | H723 | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C51 | H51 | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C43 | H431 | sing | 1.09Å | 1.10Å | |
| C43 | H432 | sing | 1.09Å | 1.10Å | |
| C43 | H433 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C42 | H423 | sing | 1.09Å | 1.10Å | |
| O3 | H3 | sing | 0.97Å | 0.95Å | |
| N21 | H211 | sing | 0.97Å | 1.00Å | |
| N21 | H212 | sing | 0.97Å | 1.00Å | |
| O1C | H1C | sing | 0.97Å | 0.95Å | |
| O12 | H12 | sing | 0.97Å | 0.95Å | |
| O10 | H10 | sing | 0.97Å | 0.95Å | |
| N4 | H42 | sing | 1.01Å | 1.00Å | |
| N7 | H7 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C94 | C93 | C95 | 111.1° | 109.5° |
| C94 | C93 | C96 | 109.9° | 109.5° |
| C94 | C93 | N92 | 108.9° | 109.5° |
| C93 | C94 | H941 | 109.5° | 109.5° |
| C93 | C94 | H942 | 109.5° | 109.5° |
| C93 | C94 | H943 | 109.5° | 109.5° |
| C95 | C93 | C96 | 109.5° | 109.5° |
| C95 | C93 | N92 | 109.8° | 109.5° |
| C93 | C95 | H951 | 109.5° | 109.5° |
| C93 | C95 | H952 | 109.4° | 109.5° |
| C93 | C95 | H953 | 109.5° | 109.5° |
| C96 | C93 | N92 | 107.5° | 109.5° |
| C93 | C96 | H961 | 109.5° | 109.5° |
| C93 | C96 | H962 | 109.5° | 109.5° |
| C93 | C96 | H963 | 109.5° | 109.5° |
| C93 | N92 | C92 | 118.5° | 111.0° |
| C93 | N92 | H92 | 107.2° | 111.0° |
| N92 | C92 | C91 | 110.7° | 109.5° |
| C92 | N92 | H92 | 107.2° | 111.0° |
| N92 | C92 | H921 | 109.2° | 109.5° |
| N92 | C92 | H922 | 109.2° | 109.5° |
| C92 | C91 | O91 | 121.6° | 120.0° |
| C92 | C91 | N9 | 113.0° | 120.0° |
| C91 | C92 | H921 | 109.2° | 109.5° |
| C91 | C92 | H922 | 109.2° | 109.4° |
| O91 | C91 | N9 | 125.4° | 120.0° |
| C91 | N9 | C9 | 129.5° | 120.0° |
| C91 | N9 | H9 | 115.2° | 119.9° |
| N9 | C9 | C8 | 125.2° | 120.1° |
| N9 | C9 | C10 | 116.5° | 120.0° |
| C9 | N9 | H9 | 115.2° | 120.1° |
| C8 | C9 | C10 | 118.3° | 119.9° |
| C9 | C8 | C7 | 123.5° | 120.4° |
| C9 | C8 | H8 | 118.3° | 119.8° |
| C9 | C10 | C1A | 118.7° | 119.6° |
| C9 | C10 | O10 | 116.1° | 120.2° |
| C8 | C7 | N7 | 114.4° | 119.8° |
| C8 | C7 | C61 | 119.7° | 120.3° |
| C7 | C8 | H8 | 118.2° | 119.8° |
| N7 | C7 | C61 | 125.9° | 119.8° |
| C7 | N7 | C71 | 107.4° | 109.5° |
| C7 | N7 | C72 | 124.8° | 109.5° |
| C7 | N7 | H7 | 102.1° | 109.5° |
| C7 | C61 | C6 | 123.4° | 120.0° |
| C7 | C61 | C1A | 115.2° | 119.9° |
| C6 | C61 | C1A | 121.4° | 120.1° |
| C61 | C6 | C51 | 115.8° | 110.2° |
| C61 | C6 | H61C | 107.9° | 109.4° |
| C61 | C6 | H62C | 107.9° | 109.3° |
| C71 | N7 | C72 | 116.3° | 109.4° |
| N7 | C71 | H711 | 109.5° | 109.5° |
| N7 | C71 | H712 | 109.5° | 109.5° |
| N7 | C71 | H713 | 109.5° | 109.4° |
| C71 | N7 | H7 | 101.2° | 109.5° |
| N7 | C72 | H721 | 109.5° | 109.5° |
| N7 | C72 | H722 | 109.5° | 109.4° |
| N7 | C72 | H723 | 109.4° | 109.5° |
| C72 | N7 | H7 | 100.9° | 109.5° |
| C61 | C1A | C11 | 118.3° | 119.7° |
| C61 | C1A | C10 | 124.6° | 119.9° |
| C6 | C51 | C5 | 119.4° | 109.6° |
| C6 | C51 | C1B | 110.5° | 110.3° |
| C51 | C6 | H61C | 107.9° | 109.4° |
| C51 | C6 | H62C | 107.9° | 109.4° |
| C6 | C51 | H51 | 104.5° | 109.0° |
| C5 | C51 | C1B | 111.9° | 110.3° |
| C51 | C5 | C41 | 109.6° | 108.1° |
| C5 | C51 | H51 | 104.2° | 109.0° |
| C51 | C5 | H51C | 109.4° | 109.7° |
| C51 | C5 | H52C | 109.4° | 109.8° |
| C51 | C1B | C12 | 117.7° | 123.1° |
| C51 | C1B | C11 | 124.4° | 118.3° |
| C1B | C51 | H51 | 104.8° | 108.6° |
| C5 | C41 | C4 | 119.6° | 112.0° |
| C5 | C41 | C1C | 108.1° | 109.2° |
| C41 | C5 | H51C | 109.4° | 109.8° |
| C41 | C5 | H52C | 109.4° | 109.7° |
| C5 | C41 | H41 | 105.9° | 108.1° |
| C4 | C41 | C1C | 110.2° | 111.7° |
| C41 | C4 | N4 | 119.5° | 108.9° |
| C41 | C4 | C3 | 115.7° | 112.2° |
| C4 | C41 | H41 | 105.6° | 108.1° |
| C41 | C4 | H4 | 103.5° | 109.0° |
| C41 | C1C | C1 | 114.0° | 108.0° |
| C41 | C1C | O1C | 106.9° | 110.5° |
| C41 | C1C | C12 | 117.8° | 109.1° |
| C1C | C41 | H41 | 106.6° | 107.6° |
| N4 | C4 | C3 | 107.6° | 108.9° |
| C4 | N4 | C43 | 107.9° | 109.4° |
| C4 | N4 | C42 | 108.0° | 109.5° |
| N4 | C4 | H4 | 104.7° | 108.9° |
| C4 | N4 | H42 | 108.1° | 109.5° |
| C4 | C3 | O3 | 114.9° | 118.8° |
| C4 | C3 | C2 | 123.4° | 122.3° |
| C3 | C4 | H4 | 104.1° | 108.9° |
| C43 | N4 | C42 | 116.6° | 109.5° |
| N4 | C43 | H431 | 109.5° | 109.5° |
| N4 | C43 | H432 | 109.4° | 109.4° |
| N4 | C43 | H433 | 109.5° | 109.5° |
| C43 | N4 | H42 | 108.1° | 109.4° |
| N4 | C42 | H421 | 109.5° | 109.5° |
| N4 | C42 | H422 | 109.5° | 109.5° |
| N4 | C42 | H423 | 109.5° | 109.5° |
| C42 | N4 | H42 | 107.9° | 109.5° |
| O3 | C3 | C2 | 121.3° | 118.9° |
| C3 | O3 | H3 | 109.5° | 117.0° |
| C3 | C2 | C21 | 120.7° | 119.9° |
| C3 | C2 | C1 | 118.1° | 120.3° |
| C21 | C2 | C1 | 121.2° | 119.9° |
| C2 | C21 | O21 | 119.5° | 120.0° |
| C2 | C21 | N21 | 118.5° | 120.0° |
| C2 | C1 | O1 | 118.2° | 120.6° |
| C2 | C1 | C1C | 123.5° | 118.8° |
| O21 | C21 | N21 | 122.0° | 120.0° |
| C21 | N21 | H211 | 120.0° | 120.0° |
| C21 | N21 | H212 | 120.0° | 120.1° |
| O1 | C1 | C1C | 117.8° | 120.6° |
| C1 | C1C | O1C | 107.2° | 110.5° |
| C1 | C1C | C12 | 106.9° | 107.7° |
| O1C | C1C | C12 | 103.0° | 110.9° |
| C1C | O1C | H1C | 109.5° | 114.0° |
| C1C | C12 | O12 | 114.8° | 117.9° |
| C1C | C12 | C1B | 124.6° | 124.1° |
| O12 | C12 | C1B | 120.6° | 118.0° |
| C12 | O12 | H12 | 109.5° | 117.0° |
| C12 | C1B | C11 | 117.6° | 118.6° |
| C1B | C11 | O11 | 118.9° | 120.6° |
| C1B | C11 | C1A | 124.5° | 118.9° |
| O11 | C11 | C1A | 116.5° | 120.6° |
| C11 | C1A | C10 | 117.1° | 120.4° |
| C1A | C10 | O10 | 125.2° | 120.2° |
| C10 | O10 | H10 | 109.5° | 114.0° |
| H941 | C94 | H942 | 109.5° | 109.5° |
| H941 | C94 | H943 | 109.5° | 109.5° |
| H942 | C94 | H943 | 109.5° | 109.5° |
| H951 | C95 | H952 | 109.5° | 109.5° |
| H951 | C95 | H953 | 109.5° | 109.5° |
| H952 | C95 | H953 | 109.5° | 109.4° |
| H961 | C96 | H962 | 109.5° | 109.5° |
| H961 | C96 | H963 | 109.4° | 109.4° |
| H962 | C96 | H963 | 109.5° | 109.4° |
| H921 | C92 | H922 | 109.4° | 109.5° |
| H711 | C71 | H712 | 109.5° | 109.5° |
| H711 | C71 | H713 | 109.4° | 109.5° |
| H712 | C71 | H713 | 109.5° | 109.5° |
| H721 | C72 | H722 | 109.5° | 109.5° |
| H721 | C72 | H723 | 109.5° | 109.5° |
| H722 | C72 | H723 | 109.5° | 109.4° |
| H61C | C6 | H62C | 109.5° | 109.2° |
| H51C | C5 | H52C | 109.5° | 109.7° |
| H431 | C43 | H432 | 109.5° | 109.5° |
| H431 | C43 | H433 | 109.5° | 109.6° |
| H432 | C43 | H433 | 109.5° | 109.4° |
| H421 | C42 | H422 | 109.4° | 109.5° |
| H421 | C42 | H423 | 109.5° | 109.4° |
| H422 | C42 | H423 | 109.5° | 109.5° |
| H211 | N21 | H212 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C94 | C93 | C95 | C96 | 121.6° | 120.0° |
| C94 | C93 | C95 | N92 | 120.6° | 120.0° |
| C94 | C93 | C96 | N92 | 118.4° | 120.0° |
| C94 | C93 | N92 | C92 | 65.5° | 60.0° |
| C93 | C94 | H941 | H942 | 120.0° | 120.0° |
| C93 | C94 | H941 | H943 | 120.0° | 120.0° |
| C93 | C94 | H942 | H943 | 120.0° | 120.0° |
| C94 | C93 | C95 | H951 | 180.0° | 60.0° |
| C94 | C93 | C95 | H952 | 60.0° | 180.0° |
| C94 | C93 | C95 | H953 | 60.0° | 60.0° |
| C94 | C93 | C96 | H961 | 180.0° | 60.0° |
| C94 | C93 | C96 | H962 | 60.0° | 180.0° |
| C94 | C93 | C96 | H963 | 60.0° | 60.0° |
| C94 | C93 | N92 | H92 | 55.8° | 176.0° |
| C95 | C93 | C96 | N92 | 119.3° | 120.0° |
| C95 | C93 | N92 | C92 | 56.4° | 60.0° |
| C95 | C93 | C94 | H941 | 180.0° | 60.0° |
| C95 | C93 | C94 | H942 | 60.0° | 180.0° |
| C95 | C93 | C94 | H943 | 60.0° | 60.0° |
| C93 | C95 | H951 | H952 | 120.0° | 120.0° |
| C93 | C95 | H951 | H953 | 120.0° | 120.0° |
| C93 | C95 | H952 | H953 | 120.0° | 120.0° |
| C95 | C93 | C96 | H961 | 57.7° | 180.0° |
| C95 | C93 | C96 | H962 | 177.7° | 60.0° |
| C95 | C93 | C96 | H963 | 62.3° | 60.0° |
| C95 | C93 | N92 | H92 | 177.7° | 63.9° |
| C96 | C93 | N92 | C92 | 175.4° | 180.0° |
| C96 | C93 | C94 | H941 | 58.7° | 180.0° |
| C96 | C93 | C94 | H942 | 178.7° | 60.0° |
| C96 | C93 | C94 | H943 | 61.3° | 60.0° |
| C96 | C93 | C95 | H951 | 58.4° | 60.0° |
| C96 | C93 | C95 | H952 | 61.6° | 60.0° |
| C96 | C93 | C95 | H953 | 178.4° | 180.0° |
| C93 | C96 | H961 | H962 | 120.0° | 120.0° |
| C93 | C96 | H961 | H963 | 120.0° | 120.0° |
| C93 | C96 | H962 | H963 | 120.0° | 120.0° |
| C96 | C93 | N92 | H92 | 63.3° | 56.1° |
| C93 | N92 | C92 | H92 | 121.3° | 124.0° |
| C93 | N92 | C92 | C91 | 106.5° | 180.0° |
| N92 | C93 | C94 | H941 | 58.8° | 60.0° |
| N92 | C93 | C94 | H942 | 61.2° | 60.0° |
| N92 | C93 | C94 | H943 | 178.8° | 180.0° |
| N92 | C93 | C95 | H951 | 59.4° | 180.0° |
| N92 | C93 | C95 | H952 | 179.4° | 60.0° |
| N92 | C93 | C95 | H953 | 60.6° | 60.0° |
| N92 | C93 | C96 | H961 | 61.6° | 60.0° |
| N92 | C93 | C96 | H962 | 58.4° | 60.0° |
| N92 | C93 | C96 | H963 | 178.4° | 180.0° |
| C93 | N92 | C92 | H921 | 13.7° | 60.0° |
| C93 | N92 | C92 | H922 | 133.3° | 60.0° |
| N92 | C92 | C91 | H921 | 120.2° | 120.1° |
| N92 | C92 | C91 | H922 | 120.2° | 120.0° |
| N92 | C92 | C91 | O91 | 63.4° | 0.0° |
| N92 | C92 | C91 | N9 | 117.0° | 180.0° |
| N92 | C92 | H921 | H922 | 119.4° | 120.0° |
| C92 | C91 | O91 | N9 | 179.7° | 180.0° |
| C92 | C91 | N9 | C9 | 179.8° | 173.8° |
| C91 | C92 | N92 | H92 | 132.2° | 56.0° |
| C91 | C92 | H921 | H922 | 119.4° | 119.9° |
| C92 | C91 | N9 | H9 | 0.2° | 6.1° |
| O91 | C91 | N9 | C9 | 0.5° | 6.2° |
| O91 | C91 | C92 | H921 | 176.4° | 120.0° |
| O91 | C91 | C92 | H922 | 56.9° | 120.0° |
| O91 | C91 | N9 | H9 | 179.5° | 173.9° |
| C91 | N9 | C9 | H9 | 180.0° | 179.9° |
| C91 | N9 | C9 | C8 | 43.7° | 24.6° |
| C91 | N9 | C9 | C10 | 138.2° | 155.1° |
| N9 | C91 | C92 | H921 | 3.3° | 59.9° |
| N9 | C91 | C92 | H922 | 122.8° | 60.0° |
| N9 | C9 | C8 | C10 | 178.0° | 179.7° |
| N9 | C9 | C8 | C7 | 178.0° | 179.7° |
| N9 | C9 | C10 | C1A | 179.0° | 179.8° |
| N9 | C9 | C10 | O10 | 2.1° | 0.0° |
| N9 | C9 | C8 | H8 | 2.0° | 0.2° |
| C9 | C8 | C7 | H8 | 180.0° | 179.9° |
| C9 | C8 | C7 | N7 | 178.7° | 180.0° |
| C9 | C8 | C7 | C61 | 0.6° | 0.0° |
| C8 | C9 | C10 | C1A | 0.8° | 0.4° |
| C8 | C9 | C10 | O10 | 179.7° | 179.8° |
| C8 | C9 | N9 | H9 | 136.3° | 155.3° |
| C10 | C9 | C8 | C7 | 0.0° | 0.0° |
| C9 | C10 | C1A | C61 | 1.0° | 0.9° |
| C9 | C10 | C1A | C11 | 179.6° | 178.9° |
| C9 | C10 | C1A | O10 | 178.8° | 179.8° |
| C10 | C9 | N9 | H9 | 41.7° | 24.9° |
| C10 | C9 | C8 | H8 | 180.0° | 179.9° |
| C9 | C10 | O10 | H10 | 178.3° | 90.0° |
| C8 | C7 | N7 | C61 | 177.9° | 180.0° |
| C8 | C7 | C61 | C6 | 179.3° | 178.6° |
| C8 | C7 | N7 | C71 | 58.1° | 55.2° |
| C8 | C7 | N7 | C72 | 160.4° | 64.8° |
| C8 | C7 | C61 | C1A | 0.4° | 0.5° |
| C8 | C7 | N7 | H7 | 47.8° | 175.2° |
| N7 | C7 | C61 | C6 | 2.8° | 1.5° |
| C7 | N7 | C71 | C72 | 145.2° | 120.0° |
| C7 | N7 | C71 | H7 | 106.6° | 120.0° |
| C7 | N7 | C72 | H7 | 113.2° | 120.0° |
| N7 | C7 | C61 | C1A | 178.2° | 179.5° |
| N7 | C7 | C8 | H8 | 1.3° | 0.1° |
| C7 | N7 | C71 | H711 | 180.0° | 60.0° |
| C7 | N7 | C71 | H712 | 60.0° | 180.0° |
| C7 | N7 | C71 | H713 | 60.0° | 60.0° |
| C7 | N7 | C72 | H721 | 180.0° | 60.0° |
| C7 | N7 | C72 | H722 | 60.0° | 60.0° |
| C7 | N7 | C72 | H723 | 60.0° | 180.0° |
| C7 | C61 | C6 | C1A | 178.9° | 179.1° |
| C61 | C7 | N7 | C71 | 119.8° | 124.8° |
| C61 | C7 | N7 | C72 | 21.6° | 115.3° |
| C7 | C61 | C6 | C51 | 163.2° | 145.3° |
| C7 | C61 | C1A | C11 | 179.8° | 178.9° |
| C7 | C61 | C1A | C10 | 0.4° | 1.0° |
| C61 | C7 | C8 | H8 | 179.4° | 179.9° |
| C7 | C61 | C6 | H61C | 42.3° | 25.0° |
| C7 | C61 | C6 | H62C | 75.9° | 94.5° |
| C61 | C7 | N7 | H7 | 134.3° | 4.8° |
| C61 | C6 | C51 | H61C | 120.9° | 120.2° |
| C61 | C6 | C51 | H62C | 120.9° | 120.2° |
| C61 | C6 | C51 | C5 | 157.4° | 175.5° |
| C61 | C6 | C51 | C1B | 25.5° | 53.9° |
| C6 | C61 | C1A | C11 | 0.8° | 2.0° |
| C6 | C61 | C1A | C10 | 178.6° | 178.1° |
| C61 | C6 | H61C | H62C | 117.2° | 119.6° |
| C61 | C6 | C51 | H51 | 86.7° | 65.3° |
| C71 | N7 | C72 | H7 | 108.3° | 120.0° |
| N7 | C71 | H711 | H712 | 120.0° | 120.0° |
| N7 | C71 | H711 | H713 | 120.0° | 119.9° |
| N7 | C71 | H712 | H713 | 120.0° | 119.9° |
| C71 | N7 | C72 | H721 | 41.5° | 60.0° |
| C71 | N7 | C72 | H722 | 161.5° | 180.0° |
| C71 | N7 | C72 | H723 | 78.5° | 60.0° |
| C72 | N7 | C71 | H711 | 34.8° | 60.0° |
| C72 | N7 | C71 | H712 | 85.3° | 60.0° |
| C72 | N7 | C71 | H713 | 154.7° | 180.0° |
| N7 | C72 | H721 | H722 | 120.0° | 120.0° |
| N7 | C72 | H721 | H723 | 120.0° | 120.0° |
| N7 | C72 | H722 | H723 | 120.0° | 120.0° |
| C1A | C61 | C6 | C51 | 18.0° | 35.7° |
| C61 | C1A | C11 | C1B | 6.8° | 12.8° |
| C61 | C1A | C11 | O11 | 174.9° | 167.2° |
| C61 | C1A | C11 | C10 | 179.4° | 179.9° |
| C61 | C1A | C10 | O10 | 179.8° | 179.3° |
| C1A | C61 | C6 | H61C | 138.9° | 155.9° |
| C1A | C61 | C6 | H62C | 102.9° | 84.6° |
| C6 | C51 | C5 | C1B | 131.3° | 121.6° |
| C6 | C51 | C5 | H51 | 116.0° | 119.2° |
| C6 | C51 | C1B | H51 | 112.0° | 119.4° |
| C6 | C51 | C5 | C41 | 172.8° | 171.4° |
| C6 | C51 | C1B | C12 | 165.6° | 137.5° |
| C6 | C51 | C1B | C11 | 20.6° | 42.4° |
| C51 | C6 | H61C | H62C | 117.1° | 119.7° |
| C6 | C51 | C5 | H51C | 52.8° | 69.0° |
| C6 | C51 | C5 | H52C | 67.1° | 51.7° |
| C5 | C51 | C1B | H51 | 112.4° | 119.4° |
| C51 | C5 | C41 | H51C | 120.0° | 119.7° |
| C51 | C5 | C41 | H52C | 120.0° | 119.7° |
| C51 | C5 | C41 | C4 | 173.9° | 166.3° |
| C51 | C5 | C41 | C1C | 59.0° | 69.5° |
| C5 | C51 | C1B | C12 | 29.9° | 16.3° |
| C5 | C51 | C1B | C11 | 156.3° | 163.6° |
| C5 | C51 | C6 | H61C | 81.7° | 64.3° |
| C5 | C51 | C6 | H62C | 36.4° | 55.3° |
| C51 | C5 | H51C | H52C | 119.9° | 120.7° |
| C51 | C5 | C41 | H41 | 55.0° | 47.3° |
| C1B | C51 | C5 | C41 | 55.9° | 49.7° |
| C51 | C1B | C12 | C1C | 8.6° | 0.7° |
| C51 | C1B | C12 | O12 | 174.0° | 179.3° |
| C51 | C1B | C12 | C11 | 174.2° | 179.9° |
| C51 | C1B | C11 | O11 | 174.1° | 171.1° |
| C51 | C1B | C11 | C1A | 4.2° | 8.9° |
| C1B | C51 | C6 | H61C | 146.4° | 174.1° |
| C1B | C51 | C6 | H62C | 95.5° | 66.3° |
| C1B | C51 | C5 | H51C | 175.9° | 169.4° |
| C1B | C51 | C5 | H52C | 64.1° | 69.9° |
| C5 | C41 | C4 | C1C | 126.1° | 122.8° |
| C5 | C41 | C4 | H41 | 119.1° | 119.0° |
| C5 | C41 | C1C | H41 | 113.5° | 117.1° |
| C5 | C41 | C4 | N4 | 135.9° | 166.3° |
| C5 | C41 | C4 | C3 | 93.0° | 73.1° |
| C5 | C41 | C1C | C1 | 88.0° | 66.1° |
| C5 | C41 | C1C | O1C | 153.6° | 172.9° |
| C5 | C41 | C1C | C12 | 38.4° | 50.7° |
| C41 | C5 | C51 | H51 | 56.8° | 69.4° |
| C41 | C5 | H51C | H52C | 119.9° | 120.7° |
| C5 | C41 | C4 | H4 | 20.1° | 47.6° |
| C4 | C41 | C1C | H41 | 114.2° | 118.5° |
| C41 | C4 | N4 | C3 | 134.6° | 122.7° |
| C41 | C4 | N4 | H4 | 115.1° | 118.7° |
| C41 | C4 | C3 | H4 | 112.8° | 120.7° |
| C41 | C4 | N4 | C43 | 71.1° | 56.2° |
| C41 | C4 | N4 | C42 | 55.7° | 176.2° |
| C41 | C4 | C3 | O3 | 165.3° | 159.3° |
| C41 | C4 | C3 | C2 | 7.6° | 20.7° |
| C4 | C41 | C1C | C1 | 44.3° | 58.2° |
| C4 | C41 | C1C | O1C | 74.0° | 62.8° |
| C4 | C41 | C1C | C12 | 170.8° | 175.0° |
| C4 | C41 | C5 | H51C | 53.9° | 46.6° |
| C4 | C41 | C5 | H52C | 66.1° | 74.0° |
| C41 | C4 | N4 | H42 | 172.2° | 63.7° |
| C1C | C41 | C4 | N4 | 98.0° | 70.9° |
| C1C | C41 | C4 | C3 | 33.1° | 49.7° |
| C41 | C1C | C1 | C2 | 33.8° | 39.6° |
| C41 | C1C | C1 | O1 | 155.2° | 140.4° |
| C41 | C1C | C1 | O1C | 118.2° | 121.0° |
| C41 | C1C | C1 | C12 | 132.0° | 117.7° |
| C41 | C1C | O1C | C12 | 124.8° | 121.1° |
| C41 | C1C | C12 | O12 | 168.8° | 163.4° |
| C41 | C1C | C12 | C1B | 13.7° | 16.6° |
| C1C | C41 | C5 | H51C | 179.0° | 170.9° |
| C1C | C41 | C5 | H52C | 61.0° | 50.2° |
| C1C | C41 | C4 | H4 | 146.3° | 170.4° |
| C41 | C1C | O1C | H1C | 180.0° | 180.0° |
| N4 | C4 | C3 | H4 | 110.7° | 118.6° |
| C4 | N4 | C43 | C42 | 121.6° | 120.0° |
| C4 | N4 | C43 | H42 | 116.7° | 120.0° |
| C4 | N4 | C42 | H42 | 116.6° | 120.1° |
| N4 | C4 | C3 | O3 | 58.2° | 80.0° |
| N4 | C4 | C3 | C2 | 128.9° | 100.0° |
| N4 | C4 | C41 | H41 | 16.8° | 47.3° |
| C4 | N4 | C43 | H431 | 180.0° | 63.5° |
| C4 | N4 | C43 | H432 | 60.0° | 176.6° |
| C4 | N4 | C43 | H433 | 60.0° | 56.6° |
| C4 | N4 | C42 | H421 | 180.0° | 60.0° |
| C4 | N4 | C42 | H422 | 60.0° | 60.0° |
| C4 | N4 | C42 | H423 | 60.0° | 179.9° |
| C3 | C4 | N4 | C43 | 63.5° | 178.9° |
| C3 | C4 | N4 | C42 | 169.7° | 61.1° |
| C4 | C3 | O3 | C2 | 173.1° | 180.0° |
| C4 | C3 | C2 | C21 | 173.9° | 178.6° |
| C4 | C3 | C2 | C1 | 7.1° | 1.4° |
| C3 | C4 | C41 | H41 | 147.9° | 168.0° |
| C4 | C3 | O3 | H3 | 173.0° | 175.0° |
| C3 | C4 | N4 | H42 | 53.2° | 58.9° |
| C43 | N4 | C42 | H42 | 121.8° | 120.0° |
| C43 | N4 | C4 | H4 | 173.7° | 62.5° |
| N4 | C43 | H431 | H432 | 120.0° | 119.9° |
| N4 | C43 | H431 | H433 | 120.0° | 120.0° |
| N4 | C43 | H432 | H433 | 120.0° | 119.9° |
| C43 | N4 | C42 | H421 | 58.4° | 59.9° |
| C43 | N4 | C42 | H422 | 61.6° | 180.0° |
| C43 | N4 | C42 | H423 | 178.4° | 60.0° |
| C42 | N4 | C4 | H4 | 59.5° | 57.5° |
| C42 | N4 | C43 | H431 | 58.4° | 56.5° |
| C42 | N4 | C43 | H432 | 178.4° | 63.4° |
| C42 | N4 | C43 | H433 | 61.6° | 176.6° |
| N4 | C42 | H421 | H422 | 120.0° | 120.1° |
| N4 | C42 | H421 | H423 | 120.0° | 120.0° |
| N4 | C42 | H422 | H423 | 120.0° | 120.0° |
| O3 | C3 | C2 | C21 | 1.4° | 1.4° |
| O3 | C3 | C2 | C1 | 179.6° | 178.6° |
| O3 | C3 | C4 | H4 | 52.5° | 38.6° |
| C3 | C2 | C21 | C1 | 179.0° | 180.0° |
| C3 | C2 | C21 | O21 | 3.4° | 95.7° |
| C3 | C2 | C21 | N21 | 177.3° | 84.4° |
| C3 | C2 | C1 | O1 | 176.9° | 168.1° |
| C3 | C2 | C1 | C1C | 5.9° | 11.9° |
| C2 | C3 | C4 | H4 | 120.4° | 141.4° |
| C2 | C3 | O3 | H3 | 0.1° | 5.0° |
| C2 | C21 | O21 | N21 | 179.3° | 180.0° |
| C21 | C2 | C1 | O1 | 2.1° | 11.8° |
| C21 | C2 | C1 | C1C | 173.1° | 168.2° |
| C2 | C21 | N21 | H211 | 179.3° | 5.0° |
| C2 | C21 | N21 | H212 | 0.7° | 175.0° |
| C1 | C2 | C21 | O21 | 177.7° | 84.3° |
| C1 | C2 | C21 | N21 | 1.7° | 95.6° |
| C2 | C1 | O1 | C1C | 171.5° | 180.0° |
| C2 | C1 | C1C | O1C | 84.4° | 81.4° |
| C2 | C1 | C1C | C12 | 165.8° | 157.3° |
| O21 | C21 | N21 | H211 | 0.0° | 175.0° |
| O21 | C21 | N21 | H212 | 180.0° | 5.1° |
| C21 | N21 | H211 | H212 | 180.0° | 180.0° |
| O1 | C1 | C1C | O1C | 86.7° | 98.6° |
| O1 | C1 | C1C | C12 | 23.2° | 22.7° |
| C1 | C1C | O1C | C12 | 112.5° | 119.3° |
| C1 | C1C | C12 | O12 | 61.4° | 79.6° |
| C1 | C1C | C12 | C1B | 116.1° | 100.4° |
| C1 | C1C | C41 | H41 | 158.5° | 176.7° |
| C1 | C1C | O1C | H1C | 57.3° | 60.5° |
| O1C | C1C | C12 | O12 | 51.4° | 41.5° |
| O1C | C1C | C12 | C1B | 131.1° | 138.5° |
| O1C | C1C | C41 | H41 | 40.1° | 55.7° |
| C1C | C12 | O12 | C1B | 177.6° | 180.0° |
| C1C | C12 | C1B | C11 | 177.1° | 179.4° |
| C12 | C1C | C41 | H41 | 75.1° | 66.5° |
| C12 | C1C | O1C | H1C | 55.2° | 58.8° |
| C1C | C12 | O12 | H12 | 177.3° | 55.1° |
| O12 | C12 | C1B | C11 | 0.3° | 0.6° |
| C12 | C1B | C11 | O11 | 0.3° | 9.0° |
| C12 | C1B | C11 | C1A | 178.0° | 171.0° |
| C12 | C1B | C51 | H51 | 82.4° | 103.1° |
| C1B | C12 | O12 | H12 | 0.4° | 125.0° |
| C1B | C11 | O11 | C1A | 178.4° | 180.0° |
| C1B | C11 | C1A | C10 | 173.8° | 167.1° |
| C11 | C1B | C51 | H51 | 91.4° | 77.0° |
| O11 | C11 | C1A | C10 | 4.6° | 12.9° |
| C11 | C1A | C10 | O10 | 0.8° | 0.9° |
| C1A | C10 | O10 | H10 | 2.9° | 89.8° |
| H941 | C94 | H942 | H943 | 120.0° | 120.0° |
| H951 | C95 | H952 | H953 | 120.0° | 120.0° |
| H961 | C96 | H962 | H963 | 120.0° | 119.9° |
| H92 | N92 | C92 | H921 | 107.6° | 176.0° |
| H92 | N92 | C92 | H922 | 12.0° | 63.9° |
| H711 | C71 | H712 | H713 | 120.0° | 120.1° |
| H711 | C71 | N7 | H7 | 73.4° | 180.0° |
| H712 | C71 | N7 | H7 | 166.5° | 60.0° |
| H713 | C71 | N7 | H7 | 46.5° | 60.0° |
| H721 | C72 | H722 | H723 | 120.0° | 120.1° |
| H721 | C72 | N7 | H7 | 66.8° | 180.0° |
| H722 | C72 | N7 | H7 | 53.2° | 60.0° |
| H723 | C72 | N7 | H7 | 173.2° | 59.9° |
| H61C | C6 | C51 | H51 | 34.2° | 54.9° |
| H62C | C6 | C51 | H51 | 152.3° | 174.5° |
| H51 | C51 | C5 | H51C | 63.2° | 50.3° |
| H51 | C51 | C5 | H52C | 176.8° | 170.9° |
| H51C | C5 | C41 | H41 | 65.1° | 72.3° |
| H52C | C5 | C41 | H41 | 175.0° | 167.0° |
| H41 | C41 | C4 | H4 | 99.0° | 71.4° |
| H4 | C4 | N4 | H42 | 57.1° | 177.5° |
| H431 | C43 | H432 | H433 | 120.0° | 120.1° |
| H431 | C43 | N4 | H42 | 63.3° | 176.5° |
| H432 | C43 | N4 | H42 | 56.7° | 56.6° |
| H433 | C43 | N4 | H42 | 176.7° | 63.4° |
| H421 | C42 | H422 | H423 | 120.0° | 119.9° |
| H421 | C42 | N4 | H42 | 63.4° | 179.9° |
| H422 | C42 | N4 | H42 | 176.7° | 60.1° |
| H423 | C42 | N4 | H42 | 56.6° | 60.0° |
