BN8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O28 | C27 | doub | 1.21Å | 1.20Å | |
| O10 | S09 | doub | 1.42Å | 1.45Å | |
| C26 | C27 | sing | 1.51Å | 1.54Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| C27 | N29 | sing | 1.35Å | 1.46Å | |
| C25 | C24 | sing | 1.53Å | 1.54Å | |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| S09 | O11 | doub | 1.42Å | 1.47Å | |
| S09 | C12 | sing | 1.76Å | 1.78Å | |
| S09 | N06 | sing | 1.66Å | 1.68Å | |
| N29 | O30 | sing | 1.42Å | 1.41Å | |
| C12 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C15 | N18 | sing | 1.40Å | 1.46Å | |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| N18 | C19 | sing | 1.35Å | 1.46Å | |
| C07 | N06 | sing | 1.47Å | 1.46Å | |
| C07 | C08 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| N06 | C05 | sing | 1.47Å | 1.45Å | |
| C19 | O20 | doub | 1.21Å | 1.18Å | |
| C19 | N21 | sing | 1.35Å | 1.45Å | |
| N21 | C22 | sing | 1.47Å | 1.45Å | |
| C08 | N03 | sing | 1.47Å | 1.44Å | |
| C05 | C04 | sing | 1.53Å | 1.52Å | |
| N03 | C04 | sing | 1.47Å | 1.45Å | |
| N03 | C02 | sing | 1.40Å | 1.43Å | |
| C31 | C02 | doub | 1.39Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.38Å | Aromatic |
| F39 | C36 | sing | 1.40Å | 1.36Å | |
| C02 | C01 | sing | 1.39Å | 1.37Å | Aromatic |
| F37 | C36 | sing | 1.40Å | 1.35Å | |
| C36 | C32 | sing | 1.51Å | 1.53Å | |
| C36 | F38 | sing | 1.40Å | 1.36Å | |
| C32 | C33 | doub | 1.38Å | 1.38Å | Aromatic |
| C01 | C34 | doub | 1.38Å | 1.37Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | CL35 | sing | 1.74Å | 1.76Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C22 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C26 | H7 | sing | 1.09Å | 1.10Å | |
| C26 | H8 | sing | 1.09Å | 1.10Å | |
| C01 | H9 | sing | 1.08Å | 1.08Å | |
| C04 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C05 | H12 | sing | 1.09Å | 1.10Å | |
| C05 | H13 | sing | 1.09Å | 1.10Å | |
| C07 | H14 | sing | 1.09Å | 1.10Å | |
| C07 | H15 | sing | 1.09Å | 1.10Å | |
| C08 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.08Å | 1.08Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.08Å | 1.08Å | |
| C33 | H25 | sing | 1.08Å | 1.08Å | |
| N18 | H26 | sing | 0.97Å | 1.00Å | |
| N21 | H27 | sing | 0.97Å | 1.00Å | |
| N29 | H28 | sing | 0.97Å | 1.00Å | |
| O30 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O28 | C27 | C26 | 121.3° | 120.0° |
| O28 | C27 | N29 | 119.5° | 120.0° |
| O10 | S09 | O11 | 112.0° | 123.1° |
| O10 | S09 | C12 | 109.7° | 106.4° |
| O10 | S09 | N06 | 112.1° | 106.4° |
| C27 | C26 | C25 | 114.1° | 109.5° |
| C26 | C27 | N29 | 119.1° | 120.0° |
| C27 | C26 | H7 | 108.3° | 109.5° |
| C27 | C26 | H8 | 108.3° | 109.5° |
| C26 | C25 | C24 | 110.5° | 109.5° |
| C25 | C26 | H7 | 108.3° | 109.5° |
| C25 | C26 | H8 | 108.3° | 109.5° |
| C26 | C25 | H22 | 109.2° | 109.5° |
| C26 | C25 | H23 | 109.2° | 109.5° |
| C27 | N29 | O30 | 119.3° | 120.0° |
| C27 | N29 | H28 | 120.3° | 120.0° |
| C25 | C24 | C23 | 111.7° | 109.5° |
| C25 | C24 | H5 | 108.9° | 109.5° |
| C25 | C24 | H6 | 108.9° | 109.5° |
| C24 | C25 | H22 | 109.2° | 109.5° |
| C24 | C25 | H23 | 109.2° | 109.4° |
| C14 | C13 | C12 | 119.0° | 120.1° |
| C13 | C14 | C15 | 119.6° | 120.0° |
| C14 | C13 | H1 | 120.5° | 120.0° |
| C13 | C14 | H18 | 120.2° | 120.0° |
| C13 | C12 | S09 | 117.5° | 119.9° |
| C13 | C12 | C17 | 122.4° | 120.1° |
| C12 | C13 | H1 | 120.5° | 119.9° |
| C14 | C15 | N18 | 117.4° | 120.1° |
| C14 | C15 | C16 | 120.8° | 119.9° |
| C15 | C14 | H18 | 120.2° | 120.0° |
| O11 | S09 | C12 | 110.6° | 106.4° |
| O11 | S09 | N06 | 107.7° | 106.4° |
| C12 | S09 | N06 | 104.5° | 107.2° |
| S09 | C12 | C17 | 120.1° | 120.0° |
| S09 | N06 | C07 | 114.3° | 120.9° |
| S09 | N06 | C05 | 115.3° | 120.9° |
| O30 | N29 | H28 | 120.3° | 120.0° |
| N29 | O30 | H29 | 109.5° | 114.0° |
| C12 | C17 | C16 | 117.8° | 120.1° |
| C12 | C17 | H2 | 121.1° | 119.9° |
| C24 | C23 | C22 | 111.0° | 109.5° |
| C23 | C24 | H5 | 108.9° | 109.5° |
| C23 | C24 | H6 | 108.9° | 109.5° |
| C24 | C23 | H20 | 109.1° | 109.5° |
| C24 | C23 | H21 | 109.1° | 109.5° |
| C23 | C22 | N21 | 107.1° | 109.5° |
| C23 | C22 | H3 | 110.1° | 109.4° |
| C23 | C22 | H4 | 110.1° | 109.5° |
| C22 | C23 | H20 | 109.1° | 109.5° |
| C22 | C23 | H21 | 109.1° | 109.4° |
| N18 | C15 | C16 | 121.9° | 120.1° |
| C15 | N18 | C19 | 125.4° | 120.0° |
| C15 | N18 | H26 | 117.3° | 119.9° |
| C15 | C16 | C17 | 120.4° | 119.9° |
| C15 | C16 | H19 | 119.8° | 120.1° |
| N18 | C19 | O20 | 122.1° | 120.1° |
| N18 | C19 | N21 | 119.2° | 119.9° |
| C19 | N18 | H26 | 117.3° | 120.1° |
| N06 | C07 | C08 | 111.7° | 108.5° |
| C07 | N06 | C05 | 112.5° | 118.2° |
| N06 | C07 | H14 | 108.9° | 109.6° |
| N06 | C07 | H15 | 108.9° | 109.6° |
| C07 | C08 | N03 | 108.2° | 109.3° |
| C08 | C07 | H14 | 108.9° | 109.6° |
| C08 | C07 | H15 | 108.9° | 109.6° |
| C07 | C08 | H16 | 109.8° | 109.4° |
| C07 | C08 | H17 | 109.8° | 109.5° |
| C16 | C17 | H2 | 121.1° | 120.0° |
| C17 | C16 | H19 | 119.8° | 120.0° |
| N06 | C05 | C04 | 110.4° | 108.6° |
| N06 | C05 | H12 | 109.2° | 109.6° |
| N06 | C05 | H13 | 109.2° | 109.8° |
| O20 | C19 | N21 | 118.7° | 120.0° |
| C19 | N21 | C22 | 118.9° | 119.9° |
| C19 | N21 | H27 | 120.6° | 120.1° |
| N21 | C22 | H3 | 110.1° | 109.5° |
| N21 | C22 | H4 | 110.1° | 109.5° |
| C22 | N21 | H27 | 120.5° | 120.0° |
| C08 | N03 | C04 | 113.6° | 111.3° |
| C08 | N03 | C02 | 121.7° | 111.0° |
| N03 | C08 | H16 | 109.8° | 109.6° |
| N03 | C08 | H17 | 109.8° | 109.5° |
| C05 | C04 | N03 | 108.5° | 109.3° |
| C05 | C04 | H10 | 109.7° | 109.5° |
| C05 | C04 | H11 | 109.7° | 109.5° |
| C04 | C05 | H12 | 109.2° | 109.6° |
| C04 | C05 | H13 | 109.2° | 109.6° |
| C04 | N03 | C02 | 120.0° | 111.0° |
| N03 | C04 | H10 | 109.7° | 109.5° |
| N03 | C04 | H11 | 109.7° | 109.5° |
| N03 | C02 | C31 | 119.1° | 120.1° |
| N03 | C02 | C01 | 118.7° | 120.0° |
| C02 | C31 | C32 | 117.4° | 119.9° |
| C31 | C02 | C01 | 122.1° | 119.9° |
| C02 | C31 | H24 | 121.3° | 120.1° |
| C31 | C32 | C36 | 117.6° | 119.9° |
| C31 | C32 | C33 | 122.0° | 120.1° |
| C32 | C31 | H24 | 121.3° | 120.0° |
| F39 | C36 | F37 | 109.0° | 109.5° |
| F39 | C36 | C32 | 109.6° | 109.5° |
| F39 | C36 | F38 | 109.4° | 109.5° |
| C02 | C01 | C34 | 119.1° | 119.9° |
| C02 | C01 | H9 | 120.4° | 120.1° |
| F37 | C36 | C32 | 107.6° | 109.5° |
| F37 | C36 | F38 | 112.1° | 109.5° |
| C32 | C36 | F38 | 109.1° | 109.4° |
| C36 | C32 | C33 | 120.4° | 120.0° |
| C32 | C33 | C34 | 118.6° | 120.2° |
| C32 | C33 | H25 | 120.7° | 119.9° |
| C01 | C34 | C33 | 120.7° | 120.0° |
| C01 | C34 | CL35 | 117.7° | 120.0° |
| C34 | C01 | H9 | 120.4° | 120.0° |
| C33 | C34 | CL35 | 121.6° | 120.0° |
| C34 | C33 | H25 | 120.7° | 120.0° |
| H3 | C22 | H4 | 109.5° | 109.5° |
| H5 | C24 | H6 | 109.5° | 109.5° |
| H7 | C26 | H8 | 109.5° | 109.5° |
| H10 | C04 | H11 | 109.5° | 109.5° |
| H12 | C05 | H13 | 109.5° | 109.6° |
| H14 | C07 | H15 | 109.5° | 109.8° |
| H16 | C08 | H17 | 109.5° | 109.6° |
| H20 | C23 | H21 | 109.5° | 109.4° |
| H22 | C25 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O28 | C27 | C26 | N29 | 179.7° | 180.0° |
| O28 | C27 | C26 | C25 | 147.1° | 0.0° |
| O28 | C27 | N29 | O30 | 0.4° | 0.0° |
| O28 | C27 | C26 | H7 | 26.4° | 120.0° |
| O28 | C27 | C26 | H8 | 92.2° | 120.0° |
| O28 | C27 | N29 | H28 | 179.6° | 180.0° |
| O10 | S09 | C12 | C13 | 33.6° | 156.5° |
| O10 | S09 | O11 | C12 | 122.7° | 123.0° |
| O10 | S09 | O11 | N06 | 123.6° | 122.9° |
| O10 | S09 | C12 | N06 | 120.3° | 113.5° |
| O10 | S09 | C12 | C17 | 149.0° | 23.5° |
| O10 | S09 | N06 | C07 | 52.7° | 23.5° |
| O10 | S09 | N06 | C05 | 174.5° | 156.4° |
| C27 | C26 | C25 | H7 | 120.7° | 120.0° |
| C27 | C26 | C25 | H8 | 120.7° | 120.0° |
| C27 | C26 | C25 | C24 | 108.8° | 180.0° |
| C26 | C27 | N29 | O30 | 179.9° | 180.0° |
| C27 | C26 | H7 | H8 | 117.9° | 120.0° |
| C27 | C26 | C25 | H22 | 11.4° | 60.0° |
| C27 | C26 | C25 | H23 | 131.1° | 60.0° |
| C26 | C27 | N29 | H28 | 0.1° | 0.0° |
| C25 | C26 | C27 | N29 | 32.6° | 180.0° |
| C26 | C25 | C24 | H22 | 120.1° | 120.0° |
| C26 | C25 | C24 | H23 | 120.2° | 120.0° |
| C26 | C25 | C24 | C23 | 78.9° | 180.0° |
| C26 | C25 | C24 | H5 | 41.4° | 60.0° |
| C26 | C25 | C24 | H6 | 160.7° | 60.0° |
| C25 | C26 | H7 | H8 | 117.9° | 120.0° |
| C26 | C25 | H22 | H23 | 119.5° | 120.0° |
| C27 | N29 | O30 | H28 | 180.0° | 180.0° |
| N29 | C27 | C26 | H7 | 153.3° | 60.0° |
| N29 | C27 | C26 | H8 | 88.1° | 60.0° |
| C27 | N29 | O30 | H29 | 0.2° | 180.0° |
| C25 | C24 | C23 | H5 | 120.3° | 120.0° |
| C25 | C24 | C23 | H6 | 120.3° | 120.0° |
| C25 | C24 | C23 | C22 | 159.1° | 180.0° |
| C25 | C24 | H5 | H6 | 119.0° | 120.0° |
| C24 | C25 | C26 | H7 | 130.6° | 60.0° |
| C24 | C25 | C26 | H8 | 11.9° | 60.0° |
| C25 | C24 | C23 | H20 | 80.7° | 60.0° |
| C25 | C24 | C23 | H21 | 38.9° | 60.0° |
| C24 | C25 | H22 | H23 | 119.5° | 120.0° |
| C14 | C13 | C12 | H1 | 180.0° | 179.7° |
| C13 | C14 | C15 | H18 | 180.0° | 179.9° |
| C14 | C13 | C12 | S09 | 178.4° | 180.0° |
| C14 | C13 | C12 | C17 | 1.0° | 0.0° |
| C13 | C14 | C15 | N18 | 179.5° | 180.0° |
| C13 | C14 | C15 | C16 | 0.3° | 0.1° |
| C12 | C13 | C14 | C15 | 0.3° | 0.1° |
| C13 | C12 | S09 | O11 | 157.6° | 23.6° |
| C13 | C12 | S09 | C17 | 177.5° | 180.0° |
| C13 | C12 | S09 | N06 | 86.8° | 90.0° |
| C13 | C12 | C17 | C16 | 0.9° | 0.0° |
| C13 | C12 | C17 | H2 | 179.1° | 180.0° |
| C12 | C13 | C14 | H18 | 179.7° | 180.0° |
| C14 | C15 | N18 | C16 | 179.8° | 179.9° |
| C14 | C15 | N18 | C19 | 152.2° | 146.7° |
| C14 | C15 | C16 | C17 | 0.4° | 0.1° |
| C15 | C14 | C13 | H1 | 179.7° | 179.8° |
| C14 | C15 | C16 | H19 | 179.6° | 180.0° |
| C14 | C15 | N18 | H26 | 27.9° | 33.3° |
| O11 | S09 | C12 | N06 | 115.6° | 113.6° |
| O11 | S09 | C12 | C17 | 24.9° | 156.4° |
| O11 | S09 | N06 | C07 | 176.3° | 156.4° |
| O11 | S09 | N06 | C05 | 50.9° | 23.5° |
| C12 | S09 | N06 | C07 | 66.0° | 90.0° |
| S09 | C12 | C17 | C16 | 178.2° | 180.0° |
| C12 | S09 | N06 | C05 | 66.8° | 90.1° |
| S09 | C12 | C13 | H1 | 1.6° | 0.3° |
| S09 | C12 | C17 | H2 | 1.8° | 0.0° |
| N06 | S09 | C12 | C17 | 90.7° | 90.0° |
| S09 | N06 | C07 | C05 | 134.1° | 179.9° |
| S09 | N06 | C07 | C08 | 171.7° | 128.8° |
| S09 | N06 | C05 | C04 | 171.5° | 128.7° |
| S09 | N06 | C05 | H12 | 51.4° | 111.5° |
| S09 | N06 | C05 | H13 | 68.3° | 8.9° |
| S09 | N06 | C07 | H14 | 68.0° | 9.1° |
| S09 | N06 | C07 | H15 | 51.4° | 111.5° |
| C12 | C17 | C16 | C15 | 0.2° | 0.0° |
| C12 | C17 | C16 | H2 | 180.0° | 180.0° |
| C17 | C12 | C13 | H1 | 179.0° | 179.7° |
| C12 | C17 | C16 | H19 | 179.8° | 180.0° |
| C24 | C23 | C22 | H20 | 120.2° | 120.0° |
| C24 | C23 | C22 | H21 | 120.2° | 120.1° |
| C24 | C23 | C22 | N21 | 160.5° | 180.0° |
| C24 | C23 | C22 | H3 | 40.9° | 60.0° |
| C24 | C23 | C22 | H4 | 79.9° | 60.0° |
| C23 | C24 | H5 | H6 | 119.0° | 120.0° |
| C24 | C23 | H20 | H21 | 119.3° | 120.1° |
| C23 | C24 | C25 | H22 | 160.9° | 60.0° |
| C23 | C24 | C25 | H23 | 41.3° | 60.0° |
| C23 | C22 | N21 | C19 | 86.8° | 180.0° |
| C23 | C22 | N21 | H3 | 119.6° | 120.0° |
| C23 | C22 | N21 | H4 | 119.6° | 120.0° |
| C23 | C22 | H3 | H4 | 121.1° | 120.0° |
| C22 | C23 | C24 | H5 | 38.7° | 60.0° |
| C22 | C23 | C24 | H6 | 80.6° | 60.0° |
| C22 | C23 | H20 | H21 | 119.3° | 119.9° |
| C23 | C22 | N21 | H27 | 93.2° | 0.0° |
| C15 | N18 | C19 | H26 | 180.0° | 180.0° |
| N18 | C15 | C16 | C17 | 179.4° | 180.0° |
| C15 | N18 | C19 | O20 | 1.0° | 5.3° |
| C15 | N18 | C19 | N21 | 179.5° | 174.7° |
| N18 | C15 | C14 | H18 | 0.5° | 0.1° |
| N18 | C15 | C16 | H19 | 0.6° | 0.0° |
| C16 | C15 | N18 | C19 | 27.7° | 33.2° |
| C15 | C16 | C17 | H19 | 180.0° | 180.0° |
| C15 | C16 | C17 | H2 | 179.8° | 179.9° |
| C16 | C15 | C14 | H18 | 179.6° | 180.0° |
| C16 | C15 | N18 | H26 | 152.3° | 146.7° |
| N18 | C19 | O20 | N21 | 179.5° | 180.0° |
| N18 | C19 | N21 | C22 | 179.4° | 180.0° |
| N18 | C19 | N21 | H27 | 0.6° | 0.0° |
| N06 | C07 | C08 | H14 | 120.3° | 119.7° |
| N06 | C07 | C08 | H15 | 120.3° | 119.7° |
| N06 | C07 | C08 | N03 | 54.2° | 53.8° |
| C07 | N06 | C05 | C04 | 54.9° | 51.2° |
| C07 | N06 | C05 | H12 | 175.0° | 68.5° |
| C07 | N06 | C05 | H13 | 65.3° | 171.0° |
| N06 | C07 | H14 | H15 | 119.0° | 120.4° |
| N06 | C07 | C08 | H16 | 174.0° | 173.8° |
| N06 | C07 | C08 | H17 | 65.6° | 66.1° |
| C08 | C07 | N06 | C05 | 54.2° | 51.2° |
| C07 | C08 | N03 | H16 | 119.8° | 119.9° |
| C07 | C08 | N03 | H17 | 119.8° | 119.9° |
| C07 | C08 | N03 | C04 | 59.0° | 63.1° |
| C07 | C08 | N03 | C02 | 145.6° | 172.8° |
| C08 | C07 | H14 | H15 | 118.9° | 120.5° |
| C07 | C08 | H16 | H17 | 120.6° | 120.1° |
| N06 | C05 | C04 | H12 | 120.1° | 119.7° |
| N06 | C05 | C04 | H13 | 120.1° | 119.9° |
| N06 | C05 | C04 | N03 | 56.1° | 53.8° |
| N06 | C05 | C04 | H10 | 63.7° | 66.1° |
| N06 | C05 | C04 | H11 | 175.9° | 173.8° |
| N06 | C05 | H12 | H13 | 119.6° | 120.6° |
| C05 | N06 | C07 | H14 | 66.1° | 170.9° |
| C05 | N06 | C07 | H15 | 174.5° | 68.6° |
| O20 | C19 | N21 | C22 | 1.0° | 0.0° |
| O20 | C19 | N18 | H26 | 179.0° | 174.7° |
| O20 | C19 | N21 | H27 | 179.0° | 180.0° |
| C19 | N21 | C22 | H27 | 180.0° | 180.0° |
| C19 | N21 | C22 | H3 | 32.8° | 60.0° |
| C19 | N21 | C22 | H4 | 153.6° | 60.0° |
| N21 | C19 | N18 | H26 | 0.5° | 5.3° |
| N21 | C22 | H3 | H4 | 121.1° | 120.0° |
| N21 | C22 | C23 | H20 | 79.3° | 60.0° |
| N21 | C22 | C23 | H21 | 40.3° | 59.9° |
| C08 | N03 | C04 | C05 | 60.5° | 63.1° |
| C08 | N03 | C04 | C02 | 155.9° | 124.2° |
| C08 | N03 | C02 | C31 | 19.8° | 180.0° |
| C08 | N03 | C02 | C01 | 159.9° | 0.0° |
| C08 | N03 | C04 | H10 | 59.3° | 56.8° |
| C08 | N03 | C04 | H11 | 179.7° | 176.9° |
| N03 | C08 | C07 | H14 | 66.1° | 173.5° |
| N03 | C08 | C07 | H15 | 174.5° | 65.9° |
| N03 | C08 | H16 | H17 | 120.6° | 120.1° |
| C05 | C04 | N03 | H10 | 119.8° | 120.0° |
| C05 | C04 | N03 | H11 | 119.8° | 119.9° |
| C05 | C04 | N03 | C02 | 143.6° | 172.7° |
| C05 | C04 | H10 | H11 | 120.4° | 120.1° |
| C04 | C05 | H12 | H13 | 119.6° | 120.4° |
| C04 | N03 | C02 | C31 | 173.7° | 55.6° |
| C04 | N03 | C02 | C01 | 6.0° | 124.3° |
| N03 | C04 | H10 | H11 | 120.5° | 120.1° |
| N03 | C04 | C05 | H12 | 176.2° | 65.9° |
| N03 | C04 | C05 | H13 | 64.0° | 173.7° |
| C04 | N03 | C08 | H16 | 178.8° | 177.0° |
| C04 | N03 | C08 | H17 | 60.8° | 56.8° |
| N03 | C02 | C31 | C01 | 179.7° | 179.9° |
| N03 | C02 | C31 | C32 | 179.5° | 180.0° |
| N03 | C02 | C01 | C34 | 179.6° | 180.0° |
| N03 | C02 | C01 | H9 | 0.4° | 0.4° |
| C02 | N03 | C04 | H10 | 96.6° | 67.3° |
| C02 | N03 | C04 | H11 | 23.8° | 52.8° |
| C02 | N03 | C08 | H16 | 25.8° | 52.8° |
| C02 | N03 | C08 | H17 | 94.6° | 67.3° |
| N03 | C02 | C31 | H24 | 0.5° | 0.0° |
| C02 | C31 | C32 | H24 | 180.0° | 180.0° |
| C02 | C31 | C32 | C36 | 179.6° | 180.0° |
| C02 | C31 | C32 | C33 | 1.1° | 0.1° |
| C31 | C02 | C01 | C34 | 0.7° | 0.0° |
| C31 | C02 | C01 | H9 | 179.3° | 179.7° |
| C31 | C32 | C36 | F39 | 58.2° | 150.0° |
| C32 | C31 | C02 | C01 | 0.2° | 0.1° |
| C31 | C32 | C36 | F37 | 60.2° | 30.0° |
| C31 | C32 | C36 | C33 | 179.3° | 179.9° |
| C31 | C32 | C36 | F38 | 178.0° | 90.0° |
| C31 | C32 | C33 | C34 | 1.0° | 0.1° |
| C31 | C32 | C33 | H25 | 178.9° | 180.0° |
| F39 | C36 | F37 | C32 | 118.8° | 120.0° |
| F39 | C36 | F37 | F38 | 121.2° | 120.0° |
| F39 | C36 | C32 | F38 | 119.8° | 120.0° |
| F39 | C36 | C32 | C33 | 122.5° | 29.9° |
| C02 | C01 | C34 | H9 | 180.0° | 179.6° |
| C02 | C01 | C34 | C33 | 0.8° | 0.0° |
| C02 | C01 | C34 | CL35 | 179.6° | 179.7° |
| C01 | C02 | C31 | H24 | 179.8° | 179.9° |
| F37 | C36 | C32 | F38 | 121.8° | 120.0° |
| F37 | C36 | C32 | C33 | 119.1° | 150.0° |
| C36 | C32 | C33 | C34 | 179.7° | 180.0° |
| C36 | C32 | C31 | H24 | 0.4° | 0.0° |
| C36 | C32 | C33 | H25 | 0.3° | 0.1° |
| F38 | C36 | C32 | C33 | 2.7° | 90.1° |
| C32 | C33 | C34 | C01 | 0.1° | 0.1° |
| C32 | C33 | C34 | H25 | 180.0° | 180.0° |
| C32 | C33 | C34 | CL35 | 179.6° | 179.7° |
| C33 | C32 | C31 | H24 | 178.9° | 179.9° |
| C01 | C34 | C33 | CL35 | 179.6° | 179.7° |
| C01 | C34 | C33 | H25 | 179.9° | 180.0° |
| C33 | C34 | C01 | H9 | 179.2° | 179.7° |
| CL35 | C34 | C01 | H9 | 0.4° | 0.0° |
| CL35 | C34 | C33 | H25 | 0.5° | 0.3° |
| H1 | C13 | C14 | H18 | 0.3° | 0.3° |
| H2 | C17 | C16 | H19 | 0.2° | 0.0° |
| H3 | C22 | C23 | H20 | 161.1° | 60.0° |
| H3 | C22 | C23 | H21 | 79.3° | 179.9° |
| H3 | C22 | N21 | H27 | 147.2° | 120.0° |
| H4 | C22 | C23 | H20 | 40.4° | 180.0° |
| H4 | C22 | C23 | H21 | 159.9° | 60.1° |
| H4 | C22 | N21 | H27 | 26.4° | 120.0° |
| H5 | C24 | C23 | H20 | 159.0° | 180.0° |
| H5 | C24 | C23 | H21 | 81.5° | 60.0° |
| H5 | C24 | C25 | H22 | 78.7° | 180.0° |
| H5 | C24 | C25 | H23 | 161.6° | 60.0° |
| H6 | C24 | C23 | H20 | 39.6° | 60.0° |
| H6 | C24 | C23 | H21 | 159.2° | 180.0° |
| H6 | C24 | C25 | H22 | 40.6° | 60.0° |
| H6 | C24 | C25 | H23 | 79.1° | 180.0° |
| H7 | C26 | C25 | H22 | 109.3° | 180.0° |
| H7 | C26 | C25 | H23 | 10.4° | 60.0° |
| H8 | C26 | C25 | H22 | 132.1° | 60.0° |
| H8 | C26 | C25 | H23 | 108.2° | 180.0° |
| H10 | C04 | C05 | H12 | 56.4° | 174.1° |
| H10 | C04 | C05 | H13 | 176.1° | 53.8° |
| H11 | C04 | C05 | H12 | 63.9° | 54.0° |
| H11 | C04 | C05 | H13 | 55.8° | 66.3° |
| H14 | C07 | C08 | H16 | 53.6° | 66.5° |
| H14 | C07 | C08 | H17 | 174.0° | 53.6° |
| H15 | C07 | C08 | H16 | 65.7° | 54.1° |
| H15 | C07 | C08 | H17 | 54.7° | 174.2° |
| H28 | N29 | O30 | H29 | 179.8° | 0.0° |
