NB4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C31 | sing | 1.43Å | 1.42Å | |
| O32 | C33 | sing | 1.43Å | 1.42Å | |
| C31 | C30 | sing | 1.53Å | 1.50Å | |
| C33 | C34 | sing | 1.53Å | 1.52Å | |
| C30 | N29 | sing | 1.47Å | 1.47Å | |
| C34 | N29 | sing | 1.47Å | 1.48Å | |
| C34 | C36 | sing | 1.53Å | 1.51Å | |
| N29 | C28 | sing | 1.47Å | 1.47Å | |
| F23 | C22 | sing | 1.35Å | 1.35Å | |
| C36 | N26 | sing | 1.47Å | 1.47Å | |
| C28 | C27 | sing | 1.53Å | 1.51Å | |
| N26 | C24 | sing | 1.39Å | 1.37Å | |
| N26 | C27 | sing | 1.47Å | 1.46Å | |
| C22 | C24 | doub | 1.39Å | 1.40Å | Aromatic |
| C22 | C04 | sing | 1.39Å | 1.37Å | Aromatic |
| C17 | N18 | sing | 1.47Å | 1.44Å | |
| C17 | C09 | sing | 1.53Å | 1.52Å | |
| O08 | C07 | doub | 1.21Å | 1.23Å | |
| N05 | N06 | sing | 1.40Å | 1.38Å | |
| N05 | C04 | sing | 1.39Å | 1.33Å | |
| N18 | O19 | sing | 1.46Å | 1.39Å | |
| N18 | C20 | sing | 1.47Å | 1.33Å | |
| C07 | N06 | sing | 1.35Å | 1.34Å | |
| C07 | C09 | sing | 1.51Å | 1.50Å | |
| C24 | N25 | sing | 1.33Å | 1.34Å | Aromatic |
| C20 | O21 | sing | 1.43Å | 1.21Å | |
| C04 | N03 | doub | 1.33Å | 1.34Å | Aromatic |
| C09 | C11 | sing | 1.53Å | 1.53Å | |
| N25 | C02 | doub | 1.32Å | 1.33Å | Aromatic |
| N03 | C02 | sing | 1.32Å | 1.33Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C02 | C01 | sing | 1.51Å | 1.49Å | |
| C12 | C13 | sing | 1.54Å | 1.54Å | |
| C12 | C16 | sing | 1.54Å | 1.53Å | |
| C13 | C14 | sing | 1.54Å | 1.52Å | |
| C16 | C15 | sing | 1.55Å | 1.55Å | |
| C14 | C15 | sing | 1.55Å | 1.50Å | |
| C11 | H43 | sing | 1.09Å | 1.10Å | |
| C11 | H42 | sing | 1.09Å | 1.10Å | |
| C12 | H44 | sing | 1.09Å | 1.10Å | |
| C13 | H46 | sing | 1.09Å | 1.10Å | |
| C13 | H45 | sing | 1.09Å | 1.10Å | |
| C14 | H48 | sing | 1.09Å | 1.10Å | |
| C14 | H47 | sing | 1.09Å | 1.10Å | |
| C01 | H39 | sing | 1.09Å | 1.10Å | |
| C01 | H38 | sing | 1.09Å | 1.10Å | |
| C01 | H37 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H49 | sing | 1.09Å | 1.10Å | |
| C15 | H50 | sing | 1.09Å | 1.10Å | |
| C16 | H51 | sing | 1.09Å | 1.10Å | |
| C16 | H52 | sing | 1.09Å | 1.10Å | |
| C17 | H53 | sing | 1.09Å | 1.10Å | |
| C17 | H54 | sing | 1.09Å | 1.10Å | |
| C20 | H1 | sing | 1.09Å | 1.10Å | |
| C27 | H57 | sing | 1.09Å | 1.10Å | |
| C27 | H58 | sing | 1.09Å | 1.10Å | |
| C28 | H59 | sing | 1.09Å | 1.10Å | |
| C28 | H60 | sing | 1.09Å | 1.10Å | |
| C30 | H61 | sing | 1.09Å | 1.10Å | |
| C30 | H62 | sing | 1.09Å | 1.10Å | |
| C31 | H63 | sing | 1.09Å | 1.10Å | |
| C31 | H64 | sing | 1.09Å | 1.10Å | |
| C33 | H66 | sing | 1.09Å | 1.10Å | |
| C33 | H65 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H68 | sing | 1.09Å | 1.10Å | |
| C36 | H67 | sing | 1.09Å | 1.10Å | |
| N05 | H40 | sing | 0.97Å | 1.00Å | |
| N06 | H41 | sing | 0.97Å | 1.00Å | |
| O19 | H3 | sing | 0.97Å | 0.95Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| O21 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | O32 | C33 | 109.2° | 113.6° |
| O32 | C31 | C30 | 111.3° | 109.2° |
| O32 | C31 | H63 | 109.0° | 109.5° |
| O32 | C31 | H64 | 109.0° | 109.6° |
| O32 | C33 | C34 | 110.9° | 109.4° |
| O32 | C33 | H66 | 109.1° | 109.4° |
| O32 | C33 | H65 | 109.1° | 109.5° |
| C31 | C30 | N29 | 109.4° | 109.4° |
| C31 | C30 | H61 | 109.5° | 109.5° |
| C31 | C30 | H62 | 109.5° | 109.5° |
| C30 | C31 | H63 | 109.0° | 109.5° |
| C30 | C31 | H64 | 109.0° | 109.5° |
| C33 | C34 | N29 | 109.7° | 109.3° |
| C33 | C34 | C36 | 110.7° | 109.2° |
| C34 | C33 | H66 | 109.1° | 109.5° |
| C34 | C33 | H65 | 109.1° | 109.6° |
| C33 | C34 | H35 | 109.0° | 109.5° |
| C30 | N29 | C34 | 109.7° | 110.9° |
| C30 | N29 | C28 | 110.0° | 110.7° |
| N29 | C30 | H61 | 109.5° | 109.5° |
| N29 | C30 | H62 | 109.5° | 109.5° |
| N29 | C34 | C36 | 108.8° | 109.4° |
| C34 | N29 | C28 | 109.8° | 110.9° |
| N29 | C34 | H35 | 109.6° | 109.5° |
| C34 | C36 | N26 | 109.5° | 109.5° |
| C36 | C34 | H35 | 109.1° | 109.8° |
| C34 | C36 | H68 | 109.4° | 109.5° |
| C34 | C36 | H67 | 109.4° | 109.5° |
| N29 | C28 | C27 | 109.5° | 109.5° |
| N29 | C28 | H59 | 109.5° | 109.4° |
| N29 | C28 | H60 | 109.5° | 109.4° |
| F23 | C22 | C24 | 122.1° | 120.9° |
| F23 | C22 | C04 | 118.6° | 120.9° |
| C36 | N26 | C24 | 122.8° | 111.0° |
| C36 | N26 | C27 | 113.0° | 110.8° |
| N26 | C36 | H68 | 109.5° | 109.5° |
| N26 | C36 | H67 | 109.4° | 109.5° |
| C28 | C27 | N26 | 109.9° | 109.3° |
| C28 | C27 | H57 | 109.4° | 109.5° |
| C28 | C27 | H58 | 109.4° | 109.5° |
| C27 | C28 | H59 | 109.5° | 109.5° |
| C27 | C28 | H60 | 109.5° | 109.5° |
| C24 | N26 | C27 | 121.2° | 111.0° |
| N26 | C24 | C22 | 123.5° | 120.5° |
| N26 | C24 | N25 | 117.4° | 120.5° |
| N26 | C27 | H57 | 109.4° | 109.5° |
| N26 | C27 | H58 | 109.4° | 109.5° |
| C24 | C22 | C04 | 119.4° | 118.2° |
| C22 | C24 | N25 | 119.1° | 119.0° |
| C22 | C04 | N05 | 121.8° | 120.4° |
| C22 | C04 | N03 | 121.0° | 119.1° |
| N18 | C17 | C09 | 112.0° | 109.5° |
| C17 | N18 | O19 | 121.0° | 111.0° |
| C17 | N18 | C20 | 120.4° | 111.0° |
| N18 | C17 | H53 | 108.8° | 109.5° |
| N18 | C17 | H54 | 108.8° | 109.5° |
| C17 | C09 | C07 | 108.1° | 109.5° |
| C17 | C09 | C11 | 113.5° | 109.4° |
| C17 | C09 | H10 | 108.8° | 109.5° |
| C09 | C17 | H53 | 108.8° | 109.4° |
| C09 | C17 | H54 | 108.8° | 109.5° |
| O08 | C07 | N06 | 122.5° | 120.0° |
| O08 | C07 | C09 | 121.9° | 120.0° |
| N06 | N05 | C04 | 122.6° | 120.0° |
| N05 | N06 | C07 | 120.4° | 120.0° |
| N06 | N05 | H40 | 106.1° | 120.0° |
| N05 | N06 | H41 | 119.8° | 120.0° |
| N05 | C04 | N03 | 117.2° | 120.5° |
| C04 | N05 | H40 | 106.1° | 120.1° |
| O19 | N18 | C20 | 118.6° | 111.0° |
| N18 | O19 | H3 | 109.5° | 114.0° |
| N18 | C20 | O21 | 124.6° | 109.4° |
| N18 | C20 | H1 | 105.6° | 109.5° |
| N18 | C20 | H4 | 105.6° | 109.4° |
| N06 | C07 | C09 | 115.6° | 119.9° |
| C07 | N06 | H41 | 119.8° | 120.0° |
| C07 | C09 | C11 | 108.7° | 109.5° |
| C07 | C09 | H10 | 109.0° | 109.5° |
| C24 | N25 | C02 | 117.9° | 120.9° |
| O21 | C20 | H1 | 105.6° | 109.5° |
| O21 | C20 | H4 | 105.6° | 109.5° |
| C20 | O21 | H2 | 109.5° | 114.0° |
| C04 | N03 | C02 | 116.7° | 120.9° |
| C09 | C11 | C12 | 116.0° | 109.5° |
| C09 | C11 | H43 | 107.8° | 109.5° |
| C09 | C11 | H42 | 107.8° | 109.4° |
| C11 | C09 | H10 | 108.6° | 109.5° |
| N25 | C02 | N03 | 125.9° | 122.0° |
| N25 | C02 | C01 | 117.0° | 119.0° |
| N03 | C02 | C01 | 117.1° | 119.0° |
| C11 | C12 | C13 | 112.9° | 110.1° |
| C11 | C12 | C16 | 112.3° | 110.0° |
| C12 | C11 | H43 | 107.8° | 109.5° |
| C12 | C11 | H42 | 107.8° | 109.5° |
| C11 | C12 | H44 | 109.4° | 110.0° |
| C02 | C01 | H39 | 109.5° | 109.5° |
| C02 | C01 | H38 | 109.5° | 109.5° |
| C02 | C01 | H37 | 109.5° | 109.5° |
| C13 | C12 | C16 | 103.5° | 106.6° |
| C12 | C13 | C14 | 105.8° | 106.6° |
| C13 | C12 | H44 | 109.3° | 110.0° |
| C12 | C13 | H46 | 110.3° | 110.1° |
| C12 | C13 | H45 | 110.4° | 110.0° |
| C12 | C16 | C15 | 105.8° | 104.2° |
| C16 | C12 | H44 | 109.3° | 110.0° |
| C12 | C16 | H51 | 110.4° | 110.5° |
| C12 | C16 | H52 | 110.4° | 110.5° |
| C13 | C14 | C15 | 107.8° | 104.2° |
| C14 | C13 | H46 | 110.4° | 110.0° |
| C14 | C13 | H45 | 110.4° | 110.0° |
| C13 | C14 | H48 | 109.9° | 110.5° |
| C13 | C14 | H47 | 109.9° | 110.5° |
| C16 | C15 | C14 | 106.7° | 102.8° |
| C16 | C15 | H49 | 110.2° | 110.8° |
| C16 | C15 | H50 | 110.1° | 111.0° |
| C15 | C16 | H51 | 110.4° | 110.4° |
| C15 | C16 | H52 | 110.4° | 110.5° |
| C15 | C14 | H48 | 109.9° | 110.5° |
| C15 | C14 | H47 | 109.9° | 110.5° |
| C14 | C15 | H49 | 110.1° | 110.7° |
| C14 | C15 | H50 | 110.2° | 110.8° |
| H43 | C11 | H42 | 109.5° | 109.4° |
| H46 | C13 | H45 | 109.5° | 110.0° |
| H48 | C14 | H47 | 109.5° | 110.6° |
| H39 | C01 | H38 | 109.5° | 109.4° |
| H39 | C01 | H37 | 109.4° | 109.5° |
| H38 | C01 | H37 | 109.5° | 109.5° |
| H49 | C15 | H50 | 109.4° | 110.7° |
| H51 | C16 | H52 | 109.5° | 110.5° |
| H53 | C17 | H54 | 109.5° | 109.5° |
| H1 | C20 | H4 | 109.5° | 109.5° |
| H57 | C27 | H58 | 109.5° | 109.5° |
| H59 | C28 | H60 | 109.5° | 109.5° |
| H61 | C30 | H62 | 109.5° | 109.4° |
| H63 | C31 | H64 | 109.5° | 109.5° |
| H66 | C33 | H65 | 109.5° | 109.5° |
| H68 | C36 | H67 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C31 | C30 | H63 | 120.3° | 119.9° |
| O32 | C31 | C30 | H64 | 120.2° | 120.0° |
| C31 | O32 | C33 | C34 | 60.4° | 58.8° |
| O32 | C31 | C30 | N29 | 59.6° | 56.9° |
| O32 | C31 | C30 | H61 | 60.4° | 63.1° |
| O32 | C31 | C30 | H62 | 179.6° | 177.0° |
| O32 | C31 | H63 | H64 | 119.2° | 120.2° |
| C31 | O32 | C33 | H66 | 59.9° | 178.7° |
| C31 | O32 | C33 | H65 | 179.5° | 61.3° |
| C33 | O32 | C31 | C30 | 61.3° | 58.9° |
| O32 | C33 | C34 | H66 | 120.2° | 119.9° |
| O32 | C33 | C34 | H65 | 120.2° | 120.0° |
| O32 | C33 | C34 | N29 | 58.2° | 56.6° |
| O32 | C33 | C34 | C36 | 178.3° | 176.3° |
| C33 | O32 | C31 | H63 | 178.4° | 61.0° |
| C33 | O32 | C31 | H64 | 59.0° | 178.8° |
| O32 | C33 | H66 | H65 | 119.4° | 120.0° |
| O32 | C33 | C34 | H35 | 61.8° | 63.4° |
| C31 | C30 | N29 | H61 | 120.0° | 120.0° |
| C31 | C30 | N29 | H62 | 120.0° | 120.0° |
| C31 | C30 | N29 | C34 | 56.2° | 58.4° |
| C31 | C30 | N29 | C28 | 177.2° | 178.1° |
| C31 | C30 | H61 | H62 | 120.1° | 120.0° |
| C30 | C31 | H63 | H64 | 119.2° | 120.1° |
| C33 | C34 | N29 | C30 | 55.8° | 58.2° |
| C33 | C34 | N29 | C36 | 121.2° | 119.5° |
| C33 | C34 | N29 | H35 | 119.7° | 120.0° |
| C33 | C34 | C36 | H35 | 120.0° | 120.1° |
| C33 | C34 | N29 | C28 | 176.8° | 178.4° |
| C33 | C34 | C36 | N26 | 178.9° | 177.9° |
| C34 | C33 | H66 | H65 | 119.4° | 120.2° |
| C33 | C34 | C36 | H68 | 58.9° | 57.8° |
| C33 | C34 | C36 | H67 | 61.1° | 62.2° |
| C30 | N29 | C34 | C28 | 121.1° | 123.4° |
| C30 | N29 | C34 | C36 | 177.0° | 177.7° |
| C30 | N29 | C28 | C27 | 177.8° | 177.4° |
| C30 | N29 | C28 | H59 | 62.2° | 57.4° |
| C30 | N29 | C28 | H60 | 57.8° | 62.6° |
| N29 | C30 | H61 | H62 | 120.0° | 120.1° |
| N29 | C30 | C31 | H63 | 179.9° | 63.0° |
| N29 | C30 | C31 | H64 | 60.6° | 176.9° |
| C30 | N29 | C34 | H35 | 63.9° | 61.8° |
| N29 | C34 | C36 | H35 | 119.4° | 120.3° |
| N29 | C34 | C36 | N26 | 58.3° | 58.3° |
| C34 | N29 | C28 | C27 | 61.3° | 59.1° |
| C34 | N29 | C28 | H59 | 58.7° | 179.1° |
| C34 | N29 | C28 | H60 | 178.7° | 60.9° |
| C34 | N29 | C30 | H61 | 63.8° | 61.6° |
| C34 | N29 | C30 | H62 | 176.2° | 178.4° |
| N29 | C34 | C33 | H66 | 62.0° | 176.5° |
| N29 | C34 | C33 | H65 | 178.4° | 63.4° |
| N29 | C34 | C36 | H68 | 61.7° | 61.8° |
| N29 | C34 | C36 | H67 | 178.3° | 178.2° |
| C36 | C34 | N29 | C28 | 61.9° | 58.9° |
| C34 | C36 | N26 | H68 | 120.0° | 120.1° |
| C34 | C36 | N26 | H67 | 120.0° | 120.0° |
| C34 | C36 | N26 | C24 | 143.3° | 176.8° |
| C34 | C36 | N26 | C27 | 56.4° | 59.4° |
| C36 | C34 | C33 | H66 | 58.0° | 63.8° |
| C36 | C34 | C33 | H65 | 61.5° | 56.3° |
| C34 | C36 | H68 | H67 | 120.0° | 120.0° |
| N29 | C28 | C27 | H59 | 120.0° | 119.9° |
| N29 | C28 | C27 | H60 | 120.0° | 120.0° |
| N29 | C28 | C27 | N26 | 57.0° | 58.5° |
| N29 | C28 | C27 | H57 | 177.0° | 178.4° |
| N29 | C28 | C27 | H58 | 63.1° | 61.4° |
| N29 | C28 | H59 | H60 | 120.0° | 120.0° |
| C28 | N29 | C30 | H61 | 57.2° | 61.9° |
| C28 | N29 | C30 | H62 | 62.9° | 58.1° |
| C28 | N29 | C34 | H35 | 57.2° | 61.5° |
| F23 | C22 | C24 | N26 | 0.3° | 0.2° |
| F23 | C22 | C24 | C04 | 180.0° | 179.8° |
| F23 | C22 | C04 | N05 | 0.8° | 0.1° |
| F23 | C22 | C24 | N25 | 178.4° | 180.0° |
| F23 | C22 | C04 | N03 | 178.9° | 180.0° |
| C36 | N26 | C27 | C28 | 55.5° | 59.5° |
| C36 | N26 | C24 | C27 | 158.7° | 123.6° |
| C36 | N26 | C24 | C22 | 34.0° | 180.0° |
| C36 | N26 | C24 | N25 | 147.8° | 0.2° |
| C36 | N26 | C27 | H57 | 175.5° | 179.5° |
| C36 | N26 | C27 | H58 | 64.6° | 60.5° |
| N26 | C36 | C34 | H35 | 61.2° | 62.0° |
| N26 | C36 | H68 | H67 | 120.0° | 120.0° |
| C28 | C27 | N26 | C24 | 143.8° | 176.7° |
| C28 | C27 | N26 | H57 | 120.0° | 119.9° |
| C28 | C27 | N26 | H58 | 120.1° | 120.0° |
| C28 | C27 | H57 | H58 | 119.8° | 120.1° |
| C27 | C28 | H59 | H60 | 120.0° | 120.1° |
| N26 | C24 | C22 | N25 | 178.2° | 179.8° |
| N26 | C24 | C22 | C04 | 179.8° | 180.0° |
| N26 | C24 | N25 | C02 | 179.6° | 179.8° |
| C24 | N26 | C27 | H57 | 23.8° | 56.8° |
| C24 | N26 | C27 | H58 | 96.1° | 63.3° |
| C24 | N26 | C36 | H68 | 96.7° | 63.1° |
| C24 | N26 | C36 | H67 | 23.3° | 56.8° |
| C27 | N26 | C24 | C22 | 167.2° | 56.4° |
| C27 | N26 | C24 | N25 | 11.0° | 123.4° |
| N26 | C27 | H57 | H58 | 119.9° | 120.0° |
| N26 | C27 | C28 | H59 | 63.1° | 178.5° |
| N26 | C27 | C28 | H60 | 177.0° | 61.5° |
| C27 | N26 | C36 | H68 | 63.6° | 60.6° |
| C27 | N26 | C36 | H67 | 176.4° | 179.4° |
| C24 | C22 | C04 | N05 | 179.2° | 179.7° |
| C24 | C22 | C04 | N03 | 1.1° | 0.1° |
| C22 | C24 | N25 | C02 | 1.3° | 0.0° |
| C22 | C04 | N05 | N06 | 144.7° | 179.9° |
| C22 | C04 | N05 | N03 | 179.7° | 179.9° |
| C04 | C22 | C24 | N25 | 1.6° | 0.2° |
| C22 | C04 | N03 | C02 | 0.4° | 0.1° |
| C22 | C04 | N05 | H40 | 22.9° | 0.1° |
| N18 | C17 | C09 | H53 | 120.4° | 120.0° |
| N18 | C17 | C09 | H54 | 120.4° | 120.0° |
| C17 | N18 | O19 | C20 | 179.1° | 123.9° |
| N18 | C17 | C09 | C07 | 178.4° | 171.2° |
| C17 | N18 | C20 | O21 | 179.1° | 70.0° |
| N18 | C17 | C09 | C11 | 60.9° | 68.8° |
| N18 | C17 | C09 | H10 | 60.2° | 51.2° |
| N18 | C17 | H53 | H54 | 118.8° | 120.0° |
| C17 | N18 | C20 | H1 | 58.8° | 50.0° |
| C17 | N18 | O19 | H3 | 180.0° | 180.0° |
| C17 | N18 | C20 | H4 | 57.1° | 170.0° |
| C17 | C09 | C07 | O08 | 62.2° | 6.1° |
| C09 | C17 | N18 | O19 | 81.5° | 73.8° |
| C09 | C17 | N18 | C20 | 97.6° | 162.3° |
| C17 | C09 | C07 | N06 | 118.9° | 173.9° |
| C17 | C09 | C07 | C11 | 123.6° | 120.0° |
| C17 | C09 | C07 | H10 | 118.1° | 120.0° |
| C17 | C09 | C11 | H10 | 121.1° | 120.0° |
| C17 | C09 | C11 | C12 | 172.5° | 69.1° |
| C17 | C09 | C11 | H43 | 66.6° | 51.0° |
| C17 | C09 | C11 | H42 | 51.5° | 170.9° |
| C09 | C17 | H53 | H54 | 118.8° | 120.0° |
| O08 | C07 | N06 | N05 | 2.5° | 5.0° |
| O08 | C07 | N06 | C09 | 178.9° | 180.0° |
| O08 | C07 | C09 | C11 | 61.4° | 113.9° |
| O08 | C07 | C09 | H10 | 179.7° | 126.1° |
| O08 | C07 | N06 | H41 | 177.5° | 174.9° |
| N06 | N05 | C04 | H40 | 121.8° | 179.9° |
| N05 | N06 | C07 | H41 | 180.0° | 179.9° |
| N05 | N06 | C07 | C09 | 178.6° | 175.0° |
| N06 | N05 | C04 | N03 | 35.0° | 0.1° |
| C04 | N05 | N06 | C07 | 72.7° | 180.0° |
| N05 | C04 | N03 | C02 | 179.9° | 180.0° |
| C04 | N05 | N06 | H41 | 107.3° | 0.0° |
| O19 | N18 | C20 | O21 | 0.0° | 166.1° |
| O19 | N18 | C17 | H53 | 158.1° | 166.2° |
| O19 | N18 | C17 | H54 | 38.8° | 46.2° |
| O19 | N18 | C20 | H1 | 122.1° | 73.9° |
| O19 | N18 | C20 | H4 | 122.0° | 46.1° |
| N18 | C20 | O21 | H1 | 122.0° | 120.0° |
| N18 | C20 | O21 | H4 | 122.0° | 120.0° |
| C20 | N18 | C17 | H53 | 22.8° | 42.3° |
| C20 | N18 | C17 | H54 | 142.0° | 77.7° |
| N18 | C20 | H1 | H4 | 113.2° | 120.0° |
| C20 | N18 | O19 | H3 | 0.9° | 56.1° |
| N18 | C20 | O21 | H2 | 180.0° | 180.0° |
| N06 | C07 | C09 | C11 | 117.5° | 66.1° |
| N06 | C07 | C09 | H10 | 0.8° | 53.9° |
| C07 | N06 | N05 | H40 | 49.1° | 0.0° |
| C07 | C09 | C11 | H10 | 118.5° | 120.0° |
| C07 | C09 | C11 | C12 | 52.1° | 50.9° |
| C07 | C09 | C11 | H43 | 173.0° | 171.0° |
| C07 | C09 | C11 | H42 | 68.9° | 69.1° |
| C07 | C09 | C17 | H53 | 61.2° | 51.2° |
| C07 | C09 | C17 | H54 | 58.1° | 68.8° |
| C09 | C07 | N06 | H41 | 1.4° | 5.0° |
| C24 | N25 | C02 | N03 | 0.6° | 0.3° |
| C24 | N25 | C02 | C01 | 178.6° | 180.0° |
| O21 | C20 | H1 | H4 | 113.2° | 120.0° |
| C04 | N03 | C02 | N25 | 0.1° | 0.3° |
| C04 | N03 | C02 | C01 | 179.1° | 180.0° |
| N03 | C04 | N05 | H40 | 156.8° | 180.0° |
| C09 | C11 | C12 | H43 | 120.9° | 120.0° |
| C09 | C11 | C12 | H42 | 121.0° | 120.0° |
| C09 | C11 | C12 | C13 | 62.3° | 170.3° |
| C09 | C11 | C12 | C16 | 178.9° | 72.5° |
| C09 | C11 | H43 | H42 | 117.0° | 119.9° |
| C09 | C11 | C12 | H44 | 59.5° | 48.8° |
| C11 | C09 | C17 | H53 | 59.5° | 171.2° |
| C11 | C09 | C17 | H54 | 178.7° | 51.2° |
| N25 | C02 | N03 | C01 | 179.2° | 179.7° |
| N25 | C02 | C01 | H39 | 0.0° | 90.2° |
| N25 | C02 | C01 | H38 | 120.0° | 29.7° |
| N25 | C02 | C01 | H37 | 120.0° | 149.8° |
| N03 | C02 | C01 | H39 | 179.3° | 90.1° |
| N03 | C02 | C01 | H38 | 59.3° | 150.0° |
| N03 | C02 | C01 | H37 | 60.7° | 29.9° |
| C11 | C12 | C13 | C16 | 121.7° | 119.3° |
| C11 | C12 | C13 | H44 | 122.0° | 121.4° |
| C11 | C12 | C16 | H44 | 121.6° | 121.4° |
| C11 | C12 | C13 | C14 | 153.1° | 119.3° |
| C11 | C12 | C16 | C15 | 152.3° | 142.9° |
| C12 | C11 | H43 | H42 | 117.1° | 120.0° |
| C11 | C12 | C13 | H46 | 87.5° | 121.4° |
| C11 | C12 | C13 | H45 | 33.6° | 0.0° |
| C12 | C11 | C09 | H10 | 66.4° | 171.0° |
| C11 | C12 | C16 | H51 | 32.8° | 24.2° |
| C11 | C12 | C16 | H52 | 88.3° | 98.4° |
| C02 | C01 | H39 | H38 | 120.0° | 120.0° |
| C02 | C01 | H39 | H37 | 120.0° | 120.0° |
| C02 | C01 | H38 | H37 | 120.0° | 120.0° |
| C13 | C12 | C16 | H44 | 116.3° | 119.3° |
| C12 | C13 | C14 | H46 | 119.4° | 119.3° |
| C12 | C13 | C14 | H45 | 119.4° | 119.3° |
| C13 | C12 | C16 | C15 | 30.2° | 23.6° |
| C12 | C13 | C14 | C15 | 20.9° | 23.6° |
| C13 | C12 | C11 | H43 | 58.6° | 69.7° |
| C13 | C12 | C11 | H42 | 176.7° | 50.3° |
| C12 | C13 | H46 | H45 | 121.7° | 121.4° |
| C12 | C13 | C14 | H48 | 98.8° | 142.3° |
| C12 | C13 | C14 | H47 | 140.7° | 95.1° |
| C13 | C12 | C16 | H51 | 89.3° | 95.1° |
| C13 | C12 | C16 | H52 | 149.6° | 142.3° |
| C16 | C12 | C13 | C14 | 31.4° | 0.0° |
| C12 | C16 | C15 | H51 | 119.4° | 118.7° |
| C12 | C16 | C15 | H52 | 119.4° | 118.7° |
| C12 | C16 | C15 | C14 | 17.9° | 37.9° |
| C16 | C12 | C11 | H43 | 58.0° | 47.5° |
| C16 | C12 | C11 | H42 | 60.1° | 167.5° |
| C16 | C12 | C13 | H46 | 150.8° | 119.3° |
| C16 | C12 | C13 | H45 | 88.0° | 119.3° |
| C12 | C16 | C15 | H49 | 137.5° | 80.4° |
| C12 | C16 | C15 | H50 | 101.7° | 156.3° |
| C12 | C16 | H51 | H52 | 121.7° | 122.6° |
| C13 | C14 | C15 | C16 | 1.8° | 37.9° |
| C13 | C14 | C15 | H48 | 119.7° | 118.7° |
| C13 | C14 | C15 | H47 | 119.8° | 118.7° |
| C14 | C13 | C12 | H44 | 85.0° | 119.3° |
| C14 | C13 | H46 | H45 | 121.7° | 121.4° |
| C13 | C14 | H48 | H47 | 120.7° | 122.6° |
| C13 | C14 | C15 | H49 | 117.8° | 80.4° |
| C13 | C14 | C15 | H50 | 121.4° | 156.5° |
| C16 | C15 | C14 | H49 | 119.6° | 118.3° |
| C16 | C15 | C14 | H50 | 119.6° | 118.6° |
| C15 | C16 | C12 | H44 | 86.2° | 95.7° |
| C16 | C15 | C14 | H48 | 117.9° | 156.6° |
| C16 | C15 | C14 | H47 | 121.6° | 80.7° |
| C16 | C15 | H49 | H50 | 121.3° | 123.5° |
| C15 | C16 | H51 | H52 | 121.7° | 122.6° |
| C15 | C14 | C13 | H46 | 140.3° | 95.7° |
| C15 | C14 | C13 | H45 | 98.5° | 142.9° |
| C15 | C14 | H48 | H47 | 120.8° | 122.7° |
| C14 | C15 | H49 | H50 | 121.3° | 123.2° |
| C14 | C15 | C16 | H51 | 101.5° | 80.8° |
| C14 | C15 | C16 | H52 | 137.3° | 156.6° |
| H43 | C11 | C12 | H44 | 179.5° | 168.9° |
| H43 | C11 | C09 | H10 | 54.5° | 69.0° |
| H42 | C11 | C12 | H44 | 61.4° | 71.1° |
| H42 | C11 | C09 | H10 | 172.6° | 51.0° |
| H44 | C12 | C13 | H46 | 34.4° | 0.0° |
| H44 | C12 | C13 | H45 | 155.6° | 121.4° |
| H44 | C12 | C16 | H51 | 154.4° | 145.6° |
| H44 | C12 | C16 | H52 | 33.3° | 23.0° |
| H46 | C13 | C14 | H48 | 20.6° | 23.0° |
| H46 | C13 | C14 | H47 | 99.9° | 145.6° |
| H45 | C13 | C14 | H48 | 141.7° | 98.4° |
| H45 | C13 | C14 | H47 | 21.2° | 24.2° |
| H48 | C14 | C15 | H49 | 122.5° | 38.3° |
| H48 | C14 | C15 | H50 | 1.7° | 84.9° |
| H47 | C14 | C15 | H49 | 2.0° | 161.0° |
| H47 | C14 | C15 | H50 | 118.8° | 37.8° |
| H39 | C01 | H38 | H37 | 120.0° | 120.0° |
| H10 | C09 | C17 | H53 | 179.5° | 68.8° |
| H10 | C09 | C17 | H54 | 60.2° | 171.2° |
| H49 | C15 | C16 | H51 | 18.1° | 161.0° |
| H49 | C15 | C16 | H52 | 103.1° | 38.4° |
| H50 | C15 | C16 | H51 | 138.9° | 37.7° |
| H50 | C15 | C16 | H52 | 17.7° | 84.9° |
| H1 | C20 | O21 | H2 | 58.0° | 60.0° |
| H57 | C27 | C28 | H59 | 57.0° | 61.6° |
| H57 | C27 | C28 | H60 | 63.0° | 58.4° |
| H58 | C27 | C28 | H59 | 176.9° | 58.5° |
| H58 | C27 | C28 | H60 | 56.9° | 178.6° |
| H61 | C30 | C31 | H63 | 59.9° | 177.0° |
| H61 | C30 | C31 | H64 | 179.4° | 56.9° |
| H62 | C30 | C31 | H63 | 60.1° | 57.1° |
| H62 | C30 | C31 | H64 | 59.3° | 63.1° |
| H66 | C33 | C34 | H35 | 178.0° | 56.5° |
| H65 | C33 | C34 | H35 | 58.4° | 176.6° |
| H35 | C34 | C36 | H68 | 178.8° | 177.9° |
| H35 | C34 | C36 | H67 | 58.8° | 57.9° |
| H40 | N05 | N06 | H41 | 130.9° | 179.9° |
| H4 | C20 | O21 | H2 | 57.9° | 60.0° |
