G1S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C31 | sing | 1.54Å | 1.53Å | |
| C30 | C29 | sing | 1.54Å | 1.54Å | |
| C31 | N28 | sing | 1.47Å | 1.46Å | |
| C29 | N28 | sing | 1.47Å | 1.46Å | |
| N28 | C16 | sing | 1.35Å | 1.34Å | |
| N14 | C15 | doub | 1.31Å | 1.34Å | Aromatic |
| N14 | C13 | sing | 1.33Å | 1.34Å | Aromatic |
| C16 | O17 | doub | 1.22Å | 1.22Å | |
| C16 | C13 | sing | 1.48Å | 1.51Å | |
| C15 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | O9 | sing | 1.35Å | 1.36Å | |
| C10 | N11 | doub | 1.33Å | 1.32Å | Aromatic |
| C12 | N11 | sing | 1.32Å | 1.34Å | Aromatic |
| O9 | C5 | sing | 1.36Å | 1.38Å | |
| C26 | C20 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.53Å | 1.50Å | |
| C20 | O19 | sing | 1.43Å | 1.48Å | |
| C6 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C3 | O19 | sing | 1.36Å | 1.38Å | |
| C3 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | C2 | sing | 1.48Å | 1.50Å | |
| O27 | C2 | doub | 1.22Å | 1.23Å | |
| C2 | N18 | sing | 1.35Å | 1.37Å | |
| N18 | C1 | sing | 1.40Å | 1.40Å | |
| C1 | C25 | sing | 1.40Å | 1.42Å | Aromatic |
| C1 | N22 | doub | 1.31Å | 1.32Å | Aromatic |
| C25 | C24 | doub | 1.35Å | 1.36Å | Aromatic |
| C40 | C39 | sing | 1.53Å | 1.47Å | |
| N22 | N23 | sing | 1.40Å | 1.35Å | Aromatic |
| C24 | N23 | sing | 1.35Å | 1.35Å | Aromatic |
| N23 | C32 | sing | 1.47Å | 1.46Å | |
| C39 | O36 | sing | 1.43Å | 1.46Å | |
| O36 | P33 | sing | 1.61Å | 1.57Å | |
| C32 | P33 | sing | 1.82Å | 1.82Å | |
| O34 | P33 | sing | 1.61Å | 1.58Å | |
| O34 | C37 | sing | 1.43Å | 1.50Å | |
| P33 | O35 | doub | 1.48Å | 1.47Å | |
| C38 | C37 | sing | 1.53Å | 1.53Å | |
| C4 | H41 | sing | 1.08Å | 1.08Å | |
| C6 | H42 | sing | 1.08Å | 1.08Å | |
| C8 | H43 | sing | 1.08Å | 1.08Å | |
| C15 | H45 | sing | 1.08Å | 1.08Å | |
| C20 | H47 | sing | 1.09Å | 1.10Å | |
| C21 | H49 | sing | 1.09Å | 1.10Å | |
| C21 | H50 | sing | 1.09Å | 1.10Å | |
| C21 | H48 | sing | 1.09Å | 1.10Å | |
| C24 | H51 | sing | 1.08Å | 1.08Å | |
| C26 | H54 | sing | 1.09Å | 1.10Å | |
| C26 | H55 | sing | 1.09Å | 1.10Å | |
| C26 | H53 | sing | 1.09Å | 1.10Å | |
| C12 | H44 | sing | 1.08Å | 1.08Å | |
| N18 | H46 | sing | 0.97Å | 1.00Å | |
| C25 | H52 | sing | 1.08Å | 1.08Å | |
| C29 | H57 | sing | 1.09Å | 1.10Å | |
| C29 | H56 | sing | 1.09Å | 1.10Å | |
| C30 | H59 | sing | 1.09Å | 1.10Å | |
| C30 | H58 | sing | 1.09Å | 1.10Å | |
| C31 | H60 | sing | 1.09Å | 1.10Å | |
| C31 | H61 | sing | 1.09Å | 1.10Å | |
| C32 | H62 | sing | 1.09Å | 1.10Å | |
| C32 | H63 | sing | 1.09Å | 1.10Å | |
| C37 | H64 | sing | 1.09Å | 1.10Å | |
| C37 | H65 | sing | 1.09Å | 1.10Å | |
| C38 | H68 | sing | 1.09Å | 1.10Å | |
| C38 | H66 | sing | 1.09Å | 1.10Å | |
| C38 | H67 | sing | 1.09Å | 1.10Å | |
| C39 | H70 | sing | 1.09Å | 1.10Å | |
| C39 | H69 | sing | 1.09Å | 1.10Å | |
| C40 | H72 | sing | 1.09Å | 1.10Å | |
| C40 | H73 | sing | 1.09Å | 1.10Å | |
| C40 | H71 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | C30 | C29 | 88.9° | 83.2° |
| C30 | C31 | N28 | 87.1° | 87.9° |
| C31 | C30 | H59 | 114.3° | 114.2° |
| C31 | C30 | H58 | 114.3° | 114.2° |
| C30 | C31 | H60 | 114.8° | 113.4° |
| C30 | C31 | H61 | 114.7° | 113.5° |
| C30 | C29 | N28 | 86.9° | 88.0° |
| C30 | C29 | H57 | 114.8° | 113.5° |
| C30 | C29 | H56 | 114.8° | 113.5° |
| C29 | C30 | H59 | 114.4° | 114.4° |
| C29 | C30 | H58 | 114.3° | 114.1° |
| C31 | N28 | C29 | 94.8° | 87.9° |
| C31 | N28 | C16 | 125.4° | 136.1° |
| N28 | C31 | H60 | 114.7° | 113.6° |
| N28 | C31 | H61 | 114.7° | 113.4° |
| C29 | N28 | C16 | 139.7° | 136.0° |
| N28 | C29 | H57 | 114.8° | 113.5° |
| N28 | C29 | H56 | 114.8° | 113.5° |
| N28 | C16 | O17 | 122.0° | 120.0° |
| N28 | C16 | C13 | 118.9° | 119.9° |
| C15 | N14 | C13 | 116.5° | 120.0° |
| N14 | C15 | C10 | 121.4° | 120.1° |
| N14 | C15 | H45 | 119.3° | 120.0° |
| N14 | C13 | C16 | 118.1° | 120.1° |
| N14 | C13 | C12 | 121.5° | 120.0° |
| O17 | C16 | C13 | 119.1° | 120.0° |
| C16 | C13 | C12 | 120.2° | 120.0° |
| C15 | C10 | O9 | 117.0° | 120.0° |
| C15 | C10 | N11 | 122.1° | 120.0° |
| C10 | C15 | H45 | 119.3° | 120.0° |
| C13 | C12 | N11 | 122.0° | 119.9° |
| C13 | C12 | H44 | 119.0° | 120.1° |
| O9 | C10 | N11 | 120.9° | 120.0° |
| C10 | O9 | C5 | 118.6° | 118.0° |
| C10 | N11 | C12 | 116.5° | 120.0° |
| N11 | C12 | H44 | 119.0° | 120.0° |
| O9 | C5 | C4 | 118.7° | 120.0° |
| O9 | C5 | C6 | 119.8° | 119.9° |
| C26 | C20 | C21 | 112.5° | 109.4° |
| C26 | C20 | O19 | 110.2° | 109.5° |
| C26 | C20 | H47 | 107.9° | 109.5° |
| C20 | C26 | H54 | 109.5° | 109.5° |
| C20 | C26 | H55 | 109.4° | 109.5° |
| C20 | C26 | H53 | 109.5° | 109.5° |
| C4 | C5 | C6 | 121.4° | 120.1° |
| C5 | C4 | C3 | 118.6° | 120.2° |
| C5 | C4 | H41 | 120.7° | 119.9° |
| C5 | C6 | C7 | 119.6° | 119.9° |
| C5 | C6 | H42 | 120.2° | 120.1° |
| C4 | C3 | O19 | 123.6° | 120.0° |
| C4 | C3 | C8 | 121.1° | 120.1° |
| C3 | C4 | H41 | 120.7° | 119.9° |
| C21 | C20 | O19 | 109.5° | 109.5° |
| C21 | C20 | H47 | 108.3° | 109.5° |
| C20 | C21 | H49 | 109.5° | 109.5° |
| C20 | C21 | H50 | 109.5° | 109.4° |
| C20 | C21 | H48 | 109.5° | 109.5° |
| C20 | O19 | C3 | 120.5° | 117.0° |
| O19 | C20 | H47 | 108.5° | 109.5° |
| C6 | C7 | C8 | 119.5° | 119.8° |
| C6 | C7 | C2 | 115.1° | 120.1° |
| C7 | C6 | H42 | 120.2° | 120.0° |
| O19 | C3 | C8 | 115.3° | 119.9° |
| C3 | C8 | C7 | 119.7° | 119.9° |
| C3 | C8 | H43 | 120.1° | 120.0° |
| C8 | C7 | C2 | 125.3° | 120.1° |
| C7 | C8 | H43 | 120.2° | 120.0° |
| C7 | C2 | O27 | 121.1° | 120.0° |
| C7 | C2 | N18 | 117.3° | 120.0° |
| O27 | C2 | N18 | 121.6° | 120.0° |
| C2 | N18 | C1 | 125.2° | 120.0° |
| C2 | N18 | H46 | 117.4° | 120.0° |
| N18 | C1 | C25 | 131.8° | 126.0° |
| N18 | C1 | N22 | 116.4° | 126.0° |
| C1 | N18 | H46 | 117.4° | 120.0° |
| C25 | C1 | N22 | 111.8° | 108.0° |
| C1 | C25 | C24 | 104.1° | 107.9° |
| C1 | C25 | H52 | 127.9° | 126.0° |
| C1 | N22 | N23 | 104.3° | 108.2° |
| C25 | C24 | N23 | 107.5° | 107.8° |
| C25 | C24 | H51 | 126.3° | 126.1° |
| C24 | C25 | H52 | 127.9° | 126.1° |
| C40 | C39 | O36 | 111.4° | 109.4° |
| C40 | C39 | H70 | 109.0° | 109.5° |
| C40 | C39 | H69 | 109.0° | 109.5° |
| C39 | C40 | H72 | 109.5° | 109.5° |
| C39 | C40 | H73 | 109.5° | 109.5° |
| C39 | C40 | H71 | 109.5° | 109.5° |
| N22 | N23 | C24 | 112.3° | 108.1° |
| N22 | N23 | C32 | 117.2° | 125.9° |
| C24 | N23 | C32 | 130.4° | 126.0° |
| N23 | C24 | H51 | 126.3° | 126.1° |
| N23 | C32 | P33 | 111.9° | 109.4° |
| N23 | C32 | H62 | 108.9° | 109.5° |
| N23 | C32 | H63 | 108.8° | 109.4° |
| C39 | O36 | P33 | 124.3° | 123.0° |
| O36 | C39 | H70 | 109.0° | 109.5° |
| O36 | C39 | H69 | 109.0° | 109.5° |
| O36 | P33 | C32 | 108.1° | 109.4° |
| O36 | P33 | O34 | 107.0° | 109.5° |
| O36 | P33 | O35 | 112.9° | 109.5° |
| C32 | P33 | O34 | 102.5° | 109.5° |
| C32 | P33 | O35 | 110.1° | 109.5° |
| P33 | C32 | H62 | 108.8° | 109.5° |
| P33 | C32 | H63 | 108.9° | 109.5° |
| P33 | O34 | C37 | 122.4° | 123.0° |
| O34 | P33 | O35 | 115.6° | 109.5° |
| O34 | C37 | C38 | 114.7° | 109.5° |
| O34 | C37 | H64 | 108.1° | 109.4° |
| O34 | C37 | H65 | 108.1° | 109.4° |
| C38 | C37 | H64 | 108.1° | 109.5° |
| C38 | C37 | H65 | 108.2° | 109.6° |
| C37 | C38 | H68 | 109.5° | 109.4° |
| C37 | C38 | H66 | 109.5° | 109.5° |
| C37 | C38 | H67 | 109.4° | 109.5° |
| H49 | C21 | H50 | 109.4° | 109.5° |
| H49 | C21 | H48 | 109.5° | 109.5° |
| H50 | C21 | H48 | 109.5° | 109.5° |
| H54 | C26 | H55 | 109.5° | 109.5° |
| H54 | C26 | H53 | 109.4° | 109.5° |
| H55 | C26 | H53 | 109.5° | 109.5° |
| H57 | C29 | H56 | 109.5° | 112.7° |
| H59 | C30 | H58 | 109.5° | 113.5° |
| H60 | C31 | H61 | 109.4° | 112.8° |
| H62 | C32 | H63 | 109.5° | 109.5° |
| H64 | C37 | H65 | 109.5° | 109.5° |
| H68 | C38 | H66 | 109.5° | 109.4° |
| H68 | C38 | H67 | 109.5° | 109.5° |
| H66 | C38 | H67 | 109.5° | 109.5° |
| H70 | C39 | H69 | 109.5° | 109.5° |
| H72 | C40 | H73 | 109.5° | 109.5° |
| H72 | C40 | H71 | 109.4° | 109.4° |
| H73 | C40 | H71 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | C30 | C29 | H59 | 116.3° | 113.5° |
| C31 | C30 | C29 | H58 | 116.3° | 113.6° |
| C30 | C31 | N28 | H60 | 116.0° | 114.8° |
| C30 | C31 | N28 | H61 | 116.0° | 114.7° |
| C31 | C30 | C29 | N28 | 11.2° | 26.2° |
| C30 | C31 | N28 | C16 | 171.0° | 152.9° |
| C31 | C30 | C29 | H57 | 104.8° | 141.1° |
| C31 | C30 | C29 | H56 | 127.1° | 88.6° |
| C31 | C30 | H59 | H58 | 129.8° | 133.2° |
| C30 | C31 | H60 | H61 | 130.6° | 130.8° |
| C30 | C29 | N28 | H57 | 115.9° | 114.8° |
| C30 | C29 | N28 | H56 | 115.9° | 114.8° |
| C30 | C29 | N28 | C16 | 171.8° | 152.9° |
| C30 | C29 | H57 | H56 | 130.7° | 130.7° |
| C29 | C30 | H59 | H58 | 129.8° | 133.2° |
| C29 | C30 | C31 | H60 | 127.2° | 88.7° |
| C29 | C30 | C31 | H61 | 104.8° | 140.8° |
| C31 | N28 | C29 | C16 | 176.4° | 179.8° |
| C31 | N28 | C16 | O17 | 6.1° | 179.7° |
| C31 | N28 | C16 | C13 | 171.3° | 0.3° |
| C31 | N28 | C29 | H57 | 104.1° | 142.1° |
| C31 | N28 | C29 | H56 | 127.7° | 87.5° |
| N28 | C31 | C30 | H59 | 127.6° | 87.5° |
| N28 | C31 | C30 | H58 | 105.1° | 139.6° |
| N28 | C31 | H60 | H61 | 130.6° | 130.8° |
| C29 | N28 | C16 | O17 | 178.2° | 0.1° |
| C29 | N28 | C16 | C13 | 4.3° | 180.0° |
| N28 | C29 | H57 | H56 | 130.8° | 130.8° |
| N28 | C29 | C30 | H59 | 127.5° | 87.3° |
| N28 | C29 | C30 | H58 | 105.1° | 139.8° |
| C29 | N28 | C31 | H60 | 127.9° | 87.5° |
| C29 | N28 | C31 | H61 | 104.1° | 142.0° |
| N28 | C16 | C13 | N14 | 35.6° | 0.3° |
| N28 | C16 | O17 | C13 | 177.4° | 180.0° |
| N28 | C16 | C13 | C12 | 149.3° | 180.0° |
| C16 | N28 | C29 | H57 | 72.3° | 38.1° |
| C16 | N28 | C29 | H56 | 55.8° | 92.3° |
| C16 | N28 | C31 | H60 | 55.0° | 92.3° |
| C16 | N28 | C31 | H61 | 73.0° | 38.2° |
| C15 | N14 | C13 | C16 | 174.2° | 180.0° |
| N14 | C15 | C10 | H45 | 180.0° | 180.0° |
| C15 | N14 | C13 | C12 | 0.9° | 0.3° |
| N14 | C15 | C10 | O9 | 175.3° | 180.0° |
| N14 | C15 | C10 | N11 | 1.2° | 0.3° |
| N14 | C13 | C16 | O17 | 141.9° | 179.7° |
| N14 | C13 | C16 | C12 | 175.1° | 179.8° |
| C13 | N14 | C15 | C10 | 0.0° | 0.0° |
| N14 | C13 | C12 | N11 | 0.6° | 0.2° |
| C13 | N14 | C15 | H45 | 180.0° | 180.0° |
| N14 | C13 | C12 | H44 | 179.3° | 180.0° |
| O17 | C16 | C13 | C12 | 33.2° | 0.0° |
| C16 | C13 | C12 | N11 | 174.3° | 180.0° |
| C16 | C13 | C12 | H44 | 5.7° | 0.2° |
| C15 | C10 | O9 | N11 | 176.5° | 179.7° |
| C15 | C10 | N11 | C12 | 1.4° | 0.3° |
| C15 | C10 | O9 | C5 | 166.5° | 175.2° |
| C13 | C12 | N11 | C10 | 0.5° | 0.1° |
| C13 | C12 | N11 | H44 | 180.0° | 179.8° |
| O9 | C10 | N11 | C12 | 174.9° | 180.0° |
| C10 | O9 | C5 | C4 | 116.7° | 114.2° |
| C10 | O9 | C5 | C6 | 66.4° | 65.8° |
| O9 | C10 | C15 | H45 | 4.7° | 0.0° |
| N11 | C10 | O9 | C5 | 17.0° | 5.1° |
| N11 | C10 | C15 | H45 | 178.9° | 179.7° |
| C10 | N11 | C12 | H44 | 179.5° | 179.7° |
| O9 | C5 | C4 | C6 | 176.9° | 179.9° |
| O9 | C5 | C4 | C3 | 175.9° | 180.0° |
| O9 | C5 | C6 | C7 | 174.6° | 180.0° |
| O9 | C5 | C4 | H41 | 4.0° | 0.3° |
| O9 | C5 | C6 | H42 | 5.4° | 0.0° |
| C26 | C20 | C21 | O19 | 122.8° | 120.0° |
| C26 | C20 | C21 | H47 | 119.1° | 120.0° |
| C26 | C20 | O19 | H47 | 117.8° | 120.0° |
| C26 | C20 | O19 | C3 | 73.1° | 146.3° |
| C26 | C20 | C21 | H49 | 180.0° | 60.0° |
| C26 | C20 | C21 | H50 | 60.0° | 180.0° |
| C26 | C20 | C21 | H48 | 60.0° | 60.0° |
| C20 | C26 | H54 | H55 | 120.0° | 120.0° |
| C20 | C26 | H54 | H53 | 120.0° | 120.0° |
| C20 | C26 | H55 | H53 | 120.0° | 120.0° |
| C5 | C4 | C3 | H41 | 180.0° | 179.7° |
| C4 | C5 | C6 | C7 | 2.2° | 0.1° |
| C5 | C4 | C3 | O19 | 177.8° | 179.7° |
| C5 | C4 | C3 | C8 | 1.5° | 0.0° |
| C4 | C5 | C6 | H42 | 177.7° | 180.0° |
| C6 | C5 | C4 | C3 | 0.9° | 0.1° |
| C5 | C6 | C7 | H42 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 1.2° | 0.1° |
| C5 | C6 | C7 | C2 | 176.4° | 180.0° |
| C6 | C5 | C4 | H41 | 179.1° | 179.7° |
| C4 | C3 | O19 | C20 | 7.7° | 173.7° |
| C4 | C3 | O19 | C8 | 179.4° | 179.8° |
| C4 | C3 | C8 | C7 | 2.5° | 0.1° |
| C4 | C3 | C8 | H43 | 177.5° | 180.0° |
| C21 | C20 | O19 | H47 | 118.0° | 120.0° |
| C21 | C20 | O19 | C3 | 162.8° | 93.8° |
| C20 | C21 | H49 | H50 | 120.0° | 120.0° |
| C20 | C21 | H49 | H48 | 120.0° | 120.0° |
| C20 | C21 | H50 | H48 | 120.0° | 120.0° |
| C21 | C20 | C26 | H54 | 180.0° | 60.0° |
| C21 | C20 | C26 | H55 | 60.0° | 180.0° |
| C21 | C20 | C26 | H53 | 60.0° | 60.0° |
| C20 | O19 | C3 | C8 | 172.9° | 6.5° |
| O19 | C20 | C21 | H49 | 57.2° | 180.0° |
| O19 | C20 | C21 | H50 | 177.2° | 60.0° |
| O19 | C20 | C21 | H48 | 62.8° | 60.0° |
| O19 | C20 | C26 | H54 | 57.5° | 60.0° |
| O19 | C20 | C26 | H55 | 62.5° | 60.0° |
| O19 | C20 | C26 | H53 | 177.5° | 180.0° |
| C6 | C7 | C8 | C3 | 1.2° | 0.1° |
| C6 | C7 | C8 | C2 | 177.3° | 179.9° |
| C6 | C7 | C2 | O27 | 16.5° | 180.0° |
| C6 | C7 | C2 | N18 | 164.3° | 0.1° |
| C6 | C7 | C8 | H43 | 178.8° | 180.0° |
| O19 | C3 | C8 | C7 | 176.8° | 179.7° |
| O19 | C3 | C4 | H41 | 2.2° | 0.0° |
| O19 | C3 | C8 | H43 | 3.1° | 0.3° |
| C3 | O19 | C20 | H47 | 44.8° | 26.3° |
| C3 | C8 | C7 | H43 | 180.0° | 180.0° |
| C3 | C8 | C7 | C2 | 178.5° | 180.0° |
| C8 | C3 | C4 | H41 | 178.5° | 179.7° |
| C8 | C7 | C2 | O27 | 160.9° | 0.1° |
| C8 | C7 | C2 | N18 | 18.3° | 180.0° |
| C8 | C7 | C6 | H42 | 178.8° | 180.0° |
| C7 | C2 | O27 | N18 | 179.2° | 179.9° |
| C7 | C2 | N18 | C1 | 177.7° | 180.0° |
| C2 | C7 | C6 | H42 | 3.6° | 0.1° |
| C2 | C7 | C8 | H43 | 1.6° | 0.1° |
| C7 | C2 | N18 | H46 | 2.3° | 0.1° |
| O27 | C2 | N18 | C1 | 3.1° | 0.1° |
| O27 | C2 | N18 | H46 | 176.9° | 180.0° |
| C2 | N18 | C1 | H46 | 180.0° | 180.0° |
| C2 | N18 | C1 | C25 | 7.8° | 0.0° |
| C2 | N18 | C1 | N22 | 170.5° | 179.8° |
| N18 | C1 | C25 | N22 | 178.4° | 179.8° |
| N18 | C1 | C25 | C24 | 179.2° | 180.0° |
| N18 | C1 | N22 | N23 | 179.6° | 179.9° |
| N18 | C1 | C25 | H52 | 0.8° | 0.3° |
| C1 | C25 | C24 | H52 | 180.0° | 179.8° |
| C25 | C1 | N22 | N23 | 1.0° | 0.4° |
| C1 | C25 | C24 | N23 | 0.3° | 0.0° |
| C1 | C25 | C24 | H51 | 179.7° | 179.7° |
| C25 | C1 | N18 | H46 | 172.2° | 180.0° |
| N22 | C1 | C25 | C24 | 0.8° | 0.2° |
| C1 | N22 | N23 | C24 | 0.8° | 0.4° |
| C1 | N22 | N23 | C32 | 175.8° | 179.7° |
| N22 | C1 | N18 | H46 | 9.5° | 0.3° |
| N22 | C1 | C25 | H52 | 179.2° | 180.0° |
| C25 | C24 | N23 | N22 | 0.3° | 0.2° |
| C25 | C24 | N23 | H51 | 180.0° | 179.7° |
| C25 | C24 | N23 | C32 | 175.7° | 179.8° |
| C40 | C39 | O36 | H70 | 120.3° | 120.0° |
| C40 | C39 | O36 | H69 | 120.3° | 120.0° |
| C40 | C39 | O36 | P33 | 132.0° | 180.0° |
| C40 | C39 | H70 | H69 | 119.1° | 120.0° |
| C39 | C40 | H72 | H73 | 120.0° | 120.0° |
| C39 | C40 | H72 | H71 | 120.0° | 120.0° |
| C39 | C40 | H73 | H71 | 120.0° | 120.0° |
| N22 | N23 | C24 | C32 | 176.0° | 180.0° |
| N22 | N23 | C32 | P33 | 79.7° | 90.0° |
| N22 | N23 | C24 | H51 | 179.7° | 180.0° |
| N22 | N23 | C32 | H62 | 40.7° | 30.0° |
| N22 | N23 | C32 | H63 | 160.0° | 150.0° |
| C24 | N23 | C32 | P33 | 96.2° | 90.0° |
| N23 | C24 | C25 | H52 | 179.7° | 179.7° |
| C24 | N23 | C32 | H62 | 143.5° | 150.0° |
| C24 | N23 | C32 | H63 | 24.2° | 30.0° |
| N23 | C32 | P33 | O36 | 54.1° | 175.0° |
| N23 | C32 | P33 | H62 | 120.4° | 120.0° |
| N23 | C32 | P33 | H63 | 120.4° | 119.9° |
| N23 | C32 | P33 | O34 | 58.6° | 65.0° |
| N23 | C32 | P33 | O35 | 177.8° | 55.1° |
| C32 | N23 | C24 | H51 | 4.3° | 0.1° |
| N23 | C32 | H62 | H63 | 118.9° | 120.0° |
| C39 | O36 | P33 | C32 | 125.8° | 175.0° |
| C39 | O36 | P33 | O34 | 16.1° | 65.0° |
| C39 | O36 | P33 | O35 | 112.2° | 55.1° |
| O36 | C39 | H70 | H69 | 119.1° | 120.0° |
| O36 | C39 | C40 | H72 | 180.0° | 60.0° |
| O36 | C39 | C40 | H73 | 60.0° | 60.0° |
| O36 | C39 | C40 | H71 | 60.0° | 180.0° |
| O36 | P33 | C32 | O34 | 112.7° | 120.0° |
| O36 | P33 | C32 | O35 | 123.7° | 120.0° |
| O36 | P33 | O34 | O35 | 126.6° | 120.0° |
| O36 | P33 | O34 | C37 | 164.9° | 65.1° |
| O36 | P33 | C32 | H62 | 66.3° | 55.0° |
| O36 | P33 | C32 | H63 | 174.5° | 65.0° |
| P33 | O36 | C39 | H70 | 11.7° | 60.0° |
| P33 | O36 | C39 | H69 | 107.7° | 60.0° |
| C32 | P33 | O34 | O35 | 119.8° | 120.0° |
| C32 | P33 | O34 | C37 | 81.5° | 175.0° |
| P33 | C32 | H62 | H63 | 118.9° | 120.0° |
| P33 | O34 | C37 | C38 | 105.0° | 179.9° |
| O34 | P33 | C32 | H62 | 179.0° | 174.9° |
| O34 | P33 | C32 | H63 | 61.8° | 54.9° |
| P33 | O34 | C37 | H64 | 134.2° | 59.9° |
| P33 | O34 | C37 | H65 | 15.8° | 60.0° |
| C37 | O34 | P33 | O35 | 38.3° | 55.0° |
| O34 | C37 | C38 | H64 | 120.8° | 120.0° |
| O34 | C37 | C38 | H65 | 120.8° | 120.0° |
| O34 | C37 | H64 | H65 | 117.6° | 119.9° |
| O34 | C37 | C38 | H68 | 180.0° | 180.0° |
| O34 | C37 | C38 | H66 | 60.0° | 60.0° |
| O34 | C37 | C38 | H67 | 60.0° | 60.0° |
| O35 | P33 | C32 | H62 | 57.5° | 65.0° |
| O35 | P33 | C32 | H63 | 61.8° | 175.0° |
| C38 | C37 | H64 | H65 | 117.6° | 120.1° |
| C37 | C38 | H68 | H66 | 120.0° | 120.0° |
| C37 | C38 | H68 | H67 | 120.0° | 120.0° |
| C37 | C38 | H66 | H67 | 120.0° | 120.0° |
| H47 | C20 | C21 | H49 | 60.9° | 60.0° |
| H47 | C20 | C21 | H50 | 59.1° | 60.0° |
| H47 | C20 | C21 | H48 | 179.1° | 180.0° |
| H47 | C20 | C26 | H54 | 60.7° | NaN° |
| H47 | C20 | C26 | H55 | 179.3° | 60.0° |
| H47 | C20 | C26 | H53 | 59.3° | 60.0° |
| H49 | C21 | H50 | H48 | 120.0° | 120.0° |
| H51 | C24 | C25 | H52 | 0.3° | 0.0° |
| H54 | C26 | H55 | H53 | 120.0° | 120.0° |
| H57 | C29 | C30 | H59 | 11.6° | 27.6° |
| H57 | C29 | C30 | H58 | 138.9° | 105.4° |
| H56 | C29 | C30 | H59 | 116.5° | 157.9° |
| H56 | C29 | C30 | H58 | 10.8° | 25.0° |
| H59 | C30 | C31 | H60 | 116.4° | 157.6° |
| H59 | C30 | C31 | H61 | 11.6° | 27.1° |
| H58 | C30 | C31 | H60 | 10.9° | 24.7° |
| H58 | C30 | C31 | H61 | 138.9° | 105.7° |
| H64 | C37 | C38 | H68 | 59.2° | 60.1° |
| H64 | C37 | C38 | H66 | 179.2° | 180.0° |
| H64 | C37 | C38 | H67 | 60.8° | 60.0° |
| H65 | C37 | C38 | H68 | 59.2° | 60.0° |
| H65 | C37 | C38 | H66 | 60.8° | 59.9° |
| H65 | C37 | C38 | H67 | 179.2° | 180.0° |
| H68 | C38 | H66 | H67 | 120.0° | 120.0° |
| H70 | C39 | C40 | H72 | 59.7° | 180.0° |
| H70 | C39 | C40 | H73 | 60.3° | 60.0° |
| H70 | C39 | C40 | H71 | 179.7° | 60.0° |
| H69 | C39 | C40 | H72 | 59.7° | 60.0° |
| H69 | C39 | C40 | H73 | 179.7° | 180.0° |
| H69 | C39 | C40 | H71 | 60.3° | 60.0° |
| H72 | C40 | H73 | H71 | 119.9° | 119.9° |
