LMJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR01 | C02 | sing | 1.89Å | 1.93Å | |
| CL08 | C07 | sing | 1.74Å | 1.75Å | |
| C02 | C07 | doub | 1.39Å | 1.40Å | Aromatic |
| C02 | C03 | sing | 1.39Å | 1.38Å | Aromatic |
| C07 | C06 | sing | 1.38Å | 1.37Å | Aromatic |
| C03 | C04 | doub | 1.39Å | 1.42Å | Aromatic |
| C06 | C05 | doub | 1.40Å | 1.41Å | Aromatic |
| C04 | C05 | sing | 1.42Å | 1.43Å | Aromatic |
| C04 | N27 | sing | 1.37Å | 1.44Å | Aromatic |
| C05 | C09 | sing | 1.45Å | 1.44Å | Aromatic |
| N27 | C10 | sing | 1.37Å | 1.42Å | Aromatic |
| C09 | C10 | doub | 1.35Å | 1.37Å | Aromatic |
| C09 | C17 | sing | 1.51Å | 1.47Å | |
| C10 | C11 | sing | 1.51Å | 1.56Å | |
| C17 | C16 | sing | 1.52Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.56Å | |
| C11 | C13 | sing | 1.53Å | 1.57Å | |
| C11 | C14 | sing | 1.54Å | 1.59Å | |
| C16 | C14 | sing | 1.53Å | 1.57Å | |
| C16 | C25 | sing | 1.54Å | 1.59Å | |
| C16 | N18 | sing | 1.48Å | 1.47Å | |
| C14 | C15 | sing | 1.54Å | 1.53Å | |
| C25 | N24 | sing | 1.46Å | 1.50Å | |
| N18 | C19 | sing | 1.37Å | 1.44Å | |
| C15 | C20 | sing | 1.52Å | 1.50Å | |
| N24 | C20 | sing | 1.48Å | 1.50Å | |
| N24 | C23 | sing | 1.47Å | 1.49Å | |
| C19 | C20 | sing | 1.52Å | 1.55Å | |
| C19 | O26 | doub | 1.21Å | 1.18Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C23 | C22 | sing | 1.55Å | 1.55Å | |
| C21 | C22 | sing | 1.55Å | 1.54Å | |
| C12 | H1 | sing | 1.09Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| N18 | H12 | sing | 0.97Å | 1.00Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C03 | H17 | sing | 1.08Å | 1.08Å | |
| C06 | H18 | sing | 1.08Å | 1.08Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| N27 | H24 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR01 | C02 | C07 | 117.7° | 118.9° |
| BR01 | C02 | C03 | 120.5° | 118.9° |
| CL08 | C07 | C02 | 118.8° | 119.1° |
| CL08 | C07 | C06 | 121.1° | 119.0° |
| C07 | C02 | C03 | 121.9° | 122.3° |
| C02 | C07 | C06 | 120.2° | 121.9° |
| C02 | C03 | C04 | 118.7° | 117.0° |
| C02 | C03 | H17 | 120.6° | 121.5° |
| C07 | C06 | C05 | 120.6° | 116.8° |
| C07 | C06 | H18 | 119.7° | 121.6° |
| C03 | C04 | C05 | 119.7° | 120.7° |
| C03 | C04 | N27 | 133.3° | 132.0° |
| C04 | C03 | H17 | 120.6° | 121.5° |
| C06 | C05 | C04 | 118.9° | 121.3° |
| C06 | C05 | C09 | 135.8° | 132.6° |
| C05 | C06 | H18 | 119.7° | 121.6° |
| C05 | C04 | N27 | 107.0° | 107.3° |
| C04 | C05 | C09 | 105.2° | 106.0° |
| C04 | N27 | C10 | 109.5° | 109.8° |
| C04 | N27 | H24 | 125.2° | 125.1° |
| C05 | C09 | C10 | 112.3° | 107.2° |
| C05 | C09 | C17 | 125.7° | 128.6° |
| N27 | C10 | C09 | 106.0° | 109.7° |
| N27 | C10 | C11 | 128.9° | 126.5° |
| C10 | N27 | H24 | 125.2° | 125.0° |
| C10 | C09 | C17 | 122.0° | 124.2° |
| C09 | C10 | C11 | 125.1° | 123.9° |
| C09 | C17 | C16 | 110.3° | 109.1° |
| C09 | C17 | H10 | 109.3° | 109.5° |
| C09 | C17 | H11 | 109.2° | 109.6° |
| C10 | C11 | C12 | 111.3° | 109.6° |
| C10 | C11 | C13 | 117.1° | 109.5° |
| C10 | C11 | C14 | 107.5° | 109.2° |
| C17 | C16 | C14 | 105.6° | 110.8° |
| C17 | C16 | C25 | 118.9° | 110.7° |
| C17 | C16 | N18 | 110.0° | 109.6° |
| C16 | C17 | H10 | 109.3° | 109.6° |
| C16 | C17 | H11 | 109.3° | 109.6° |
| C12 | C11 | C13 | 106.6° | 109.5° |
| C12 | C11 | C14 | 105.1° | 109.5° |
| C11 | C12 | H1 | 109.5° | 109.4° |
| C11 | C12 | H2 | 109.5° | 109.5° |
| C11 | C12 | H3 | 109.5° | 109.5° |
| C13 | C11 | C14 | 108.6° | 109.5° |
| C11 | C13 | H4 | 109.5° | 109.5° |
| C11 | C13 | H5 | 109.5° | 109.5° |
| C11 | C13 | H6 | 109.5° | 109.5° |
| C11 | C14 | C16 | 117.6° | 109.3° |
| C11 | C14 | C15 | 110.1° | 107.8° |
| C11 | C14 | H7 | 105.7° | 110.0° |
| C14 | C16 | C25 | 116.1° | 109.1° |
| C14 | C16 | N18 | 106.2° | 109.5° |
| C16 | C14 | C15 | 110.2° | 109.0° |
| C16 | C14 | H7 | 106.0° | 110.6° |
| C25 | C16 | N18 | 99.2° | 107.2° |
| C16 | C25 | N24 | 107.9° | 108.5° |
| C16 | C25 | H21 | 109.9° | 109.7° |
| C16 | C25 | H22 | 109.8° | 109.7° |
| C16 | N18 | C19 | 114.0° | 111.9° |
| C16 | N18 | H12 | 123.0° | 124.1° |
| C14 | C15 | C20 | 109.1° | 107.2° |
| C15 | C14 | H7 | 106.4° | 110.1° |
| C14 | C15 | H8 | 109.6° | 109.9° |
| C14 | C15 | H9 | 109.6° | 109.9° |
| C25 | N24 | C20 | 110.5° | 111.2° |
| C25 | N24 | C23 | 114.0° | 115.5° |
| N24 | C25 | H21 | 109.9° | 109.6° |
| N24 | C25 | H22 | 109.9° | 109.6° |
| N18 | C19 | C20 | 109.6° | 112.0° |
| N18 | C19 | O26 | 122.1° | 124.0° |
| C19 | N18 | H12 | 123.0° | 124.0° |
| C15 | C20 | N24 | 110.5° | 108.7° |
| C15 | C20 | C19 | 109.5° | 108.6° |
| C15 | C20 | C21 | 113.6° | 115.0° |
| C20 | C15 | H8 | 109.6° | 109.9° |
| C20 | C15 | H9 | 109.5° | 109.9° |
| C20 | N24 | C23 | 104.0° | 103.8° |
| N24 | C20 | C19 | 107.1° | 109.1° |
| N24 | C20 | C21 | 105.2° | 104.8° |
| N24 | C23 | C22 | 104.8° | 103.9° |
| N24 | C23 | H15 | 110.6° | 110.5° |
| N24 | C23 | H16 | 110.7° | 110.7° |
| C20 | C19 | O26 | 128.2° | 124.0° |
| C19 | C20 | C21 | 110.6° | 110.4° |
| C20 | C21 | C22 | 103.2° | 104.2° |
| C20 | C21 | H13 | 111.0° | 110.5° |
| C20 | C21 | H14 | 111.0° | 110.5° |
| C23 | C22 | C21 | 107.0° | 104.9° |
| C22 | C23 | H15 | 110.6° | 110.6° |
| C22 | C23 | H16 | 110.6° | 110.5° |
| C23 | C22 | H19 | 110.1° | 110.3° |
| C23 | C22 | H20 | 110.1° | 110.3° |
| C22 | C21 | H13 | 111.0° | 110.5° |
| C22 | C21 | H14 | 111.0° | 110.4° |
| C21 | C22 | H19 | 110.1° | 110.3° |
| C21 | C22 | H20 | 110.1° | 110.3° |
| H1 | C12 | H2 | 109.5° | 109.5° |
| H1 | C12 | H3 | 109.4° | 109.4° |
| H2 | C12 | H3 | 109.5° | 109.5° |
| H4 | C13 | H5 | 109.5° | 109.4° |
| H4 | C13 | H6 | 109.5° | 109.5° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 110.0° |
| H10 | C17 | H11 | 109.5° | 109.5° |
| H13 | C21 | H14 | 109.5° | 110.6° |
| H15 | C23 | H16 | 109.5° | 110.5° |
| H19 | C22 | H20 | 109.5° | 110.4° |
| H21 | C25 | H22 | 109.4° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR01 | C02 | C07 | CL08 | 0.1° | 0.1° |
| BR01 | C02 | C07 | C03 | 179.9° | 180.0° |
| BR01 | C02 | C07 | C06 | 179.9° | 179.9° |
| BR01 | C02 | C03 | C04 | 180.0° | 180.0° |
| BR01 | C02 | C03 | H17 | 0.0° | 0.1° |
| CL08 | C07 | C02 | C06 | 179.8° | 180.0° |
| CL08 | C07 | C02 | C03 | 179.8° | 180.0° |
| CL08 | C07 | C06 | C05 | 179.8° | 180.0° |
| CL08 | C07 | C06 | H18 | 0.2° | 0.1° |
| C07 | C02 | C03 | C04 | 0.1° | 0.0° |
| C02 | C07 | C06 | C05 | 0.0° | 0.0° |
| C07 | C02 | C03 | H17 | 179.9° | 179.9° |
| C02 | C07 | C06 | H18 | 180.0° | 179.9° |
| C03 | C02 | C07 | C06 | 0.0° | 0.0° |
| C02 | C03 | C04 | H17 | 180.0° | 179.9° |
| C02 | C03 | C04 | C05 | 0.1° | 0.1° |
| C02 | C03 | C04 | N27 | 179.9° | 179.9° |
| C07 | C06 | C05 | H18 | 180.0° | 179.9° |
| C07 | C06 | C05 | C04 | 0.1° | 0.1° |
| C07 | C06 | C05 | C09 | 179.9° | 179.9° |
| C03 | C04 | C05 | C06 | 0.1° | 0.1° |
| C03 | C04 | C05 | N27 | 180.0° | 180.0° |
| C03 | C04 | C05 | C09 | 180.0° | 179.8° |
| C03 | C04 | N27 | C10 | 179.9° | 180.0° |
| C03 | C04 | N27 | H24 | 0.1° | 0.1° |
| C06 | C05 | C04 | C09 | 179.8° | 179.9° |
| C06 | C05 | C04 | N27 | 179.9° | 179.9° |
| C06 | C05 | C09 | C10 | 180.0° | 179.8° |
| C06 | C05 | C09 | C17 | 0.8° | 0.3° |
| C05 | C04 | N27 | C10 | 0.1° | 0.0° |
| C04 | C05 | C09 | C10 | 0.2° | 0.3° |
| C04 | C05 | C09 | C17 | 179.4° | 179.6° |
| C05 | C04 | C03 | H17 | 179.9° | 180.0° |
| C04 | C05 | C06 | H18 | 179.9° | 179.9° |
| C05 | C04 | N27 | H24 | 179.8° | 179.9° |
| N27 | C04 | C05 | C09 | 0.0° | 0.2° |
| C04 | N27 | C10 | H24 | 180.0° | 179.9° |
| C04 | N27 | C10 | C09 | 0.2° | 0.1° |
| C04 | N27 | C10 | C11 | 179.7° | 180.0° |
| N27 | C04 | C03 | H17 | 0.1° | 0.0° |
| C05 | C09 | C10 | N27 | 0.2° | 0.2° |
| C05 | C09 | C10 | C17 | 179.3° | 179.9° |
| C05 | C09 | C10 | C11 | 179.7° | 179.9° |
| C05 | C09 | C17 | C16 | 142.8° | 164.7° |
| C05 | C09 | C17 | H10 | 97.0° | 44.8° |
| C05 | C09 | C17 | H11 | 22.7° | 75.4° |
| C09 | C05 | C06 | H18 | 0.1° | 0.2° |
| N27 | C10 | C09 | C11 | 179.9° | 179.9° |
| N27 | C10 | C09 | C17 | 179.5° | 179.7° |
| N27 | C10 | C11 | C12 | 72.4° | 42.6° |
| N27 | C10 | C11 | C13 | 50.6° | 77.6° |
| N27 | C10 | C11 | C14 | 173.0° | 162.5° |
| C10 | C09 | C17 | C16 | 36.3° | 15.4° |
| C09 | C10 | C11 | C12 | 107.7° | 137.3° |
| C09 | C10 | C11 | C13 | 129.3° | 102.5° |
| C09 | C10 | C11 | C14 | 6.9° | 17.4° |
| C10 | C09 | C17 | H10 | 83.8° | 135.3° |
| C10 | C09 | C17 | H11 | 156.5° | 104.5° |
| C09 | C10 | N27 | H24 | 179.8° | 179.9° |
| C17 | C09 | C10 | C11 | 0.4° | 0.2° |
| C09 | C17 | C16 | H10 | 120.1° | 119.9° |
| C09 | C17 | C16 | H11 | 120.1° | 119.9° |
| C09 | C17 | C16 | C14 | 61.0° | 48.1° |
| C09 | C17 | C16 | C25 | 71.5° | 73.0° |
| C09 | C17 | C16 | N18 | 175.2° | 169.0° |
| C09 | C17 | H10 | H11 | 119.6° | 120.2° |
| C10 | C11 | C12 | C13 | 128.8° | 120.2° |
| C10 | C11 | C12 | C14 | 116.1° | 119.8° |
| C10 | C11 | C13 | C14 | 121.9° | 119.7° |
| C10 | C11 | C14 | C16 | 23.5° | 49.1° |
| C10 | C11 | C14 | C15 | 150.8° | 167.4° |
| C10 | C11 | C12 | H1 | 180.0° | 60.1° |
| C10 | C11 | C12 | H2 | 60.0° | 59.8° |
| C10 | C11 | C12 | H3 | 60.0° | 179.9° |
| C10 | C11 | C13 | H4 | 180.0° | 20.6° |
| C10 | C11 | C13 | H5 | 60.0° | 99.4° |
| C10 | C11 | C13 | H6 | 60.0° | 140.6° |
| C10 | C11 | C14 | H7 | 94.6° | 72.6° |
| C11 | C10 | N27 | H24 | 0.4° | 0.1° |
| C17 | C16 | C14 | C11 | 57.4° | 67.9° |
| C17 | C16 | C14 | C25 | 134.1° | 122.0° |
| C17 | C16 | C14 | N18 | 116.8° | 120.9° |
| C17 | C16 | C25 | N18 | 119.0° | 119.4° |
| C17 | C16 | C14 | C15 | 175.3° | 174.6° |
| C17 | C16 | C25 | N24 | 167.3° | 175.7° |
| C17 | C16 | N18 | C19 | 174.8° | 175.4° |
| C17 | C16 | C14 | H7 | 60.6° | 53.4° |
| C16 | C17 | H10 | H11 | 119.6° | 120.2° |
| C17 | C16 | N18 | H12 | 5.2° | 4.6° |
| C17 | C16 | C25 | H21 | 72.9° | 64.7° |
| C17 | C16 | C25 | H22 | 47.6° | 55.9° |
| C12 | C11 | C13 | C14 | 112.8° | 120.0° |
| C12 | C11 | C14 | C16 | 142.1° | 169.1° |
| C12 | C11 | C14 | C15 | 90.5° | 72.6° |
| C11 | C12 | H1 | H2 | 120.0° | 119.9° |
| C11 | C12 | H1 | H3 | 120.0° | 120.0° |
| C11 | C12 | H2 | H3 | 120.0° | 120.1° |
| C12 | C11 | C13 | H4 | 54.7° | 140.8° |
| C12 | C11 | C13 | H5 | 174.7° | 20.9° |
| C12 | C11 | C13 | H6 | 65.3° | 99.2° |
| C12 | C11 | C14 | H7 | 24.0° | 47.4° |
| C13 | C11 | C14 | C16 | 104.1° | 70.9° |
| C13 | C11 | C14 | C15 | 23.2° | 47.4° |
| C13 | C11 | C12 | H1 | 51.2° | 60.1° |
| C13 | C11 | C12 | H2 | 68.8° | 180.0° |
| C13 | C11 | C12 | H3 | 171.2° | 59.9° |
| C11 | C13 | H4 | H5 | 120.0° | 120.0° |
| C11 | C13 | H4 | H6 | 120.0° | 120.1° |
| C11 | C13 | H5 | H6 | 120.0° | 120.1° |
| C13 | C11 | C14 | H7 | 137.8° | 167.5° |
| C11 | C14 | C16 | C15 | 127.3° | 117.5° |
| C11 | C14 | C16 | H7 | 117.9° | 121.3° |
| C11 | C14 | C16 | C25 | 76.7° | 54.2° |
| C11 | C14 | C16 | N18 | 174.1° | 171.2° |
| C11 | C14 | C15 | H7 | 114.1° | 120.0° |
| C11 | C14 | C15 | C20 | 131.5° | 111.3° |
| C14 | C11 | C12 | H1 | 63.9° | 179.9° |
| C14 | C11 | C12 | H2 | 176.1° | 59.9° |
| C14 | C11 | C12 | H3 | 56.1° | 60.1° |
| C14 | C11 | C13 | H4 | 58.1° | 99.2° |
| C14 | C11 | C13 | H5 | 61.9° | 140.9° |
| C14 | C11 | C13 | H6 | 178.1° | 20.9° |
| C11 | C14 | C15 | H8 | 11.5° | 8.1° |
| C11 | C14 | C15 | H9 | 108.6° | 129.2° |
| C14 | C16 | C25 | N18 | 113.2° | 118.5° |
| C16 | C14 | C15 | H7 | 114.5° | 121.5° |
| C14 | C16 | C25 | N24 | 39.6° | 53.6° |
| C14 | C16 | N18 | C19 | 61.0° | 62.9° |
| C16 | C14 | C15 | C20 | 0.1° | 7.1° |
| C16 | C14 | C15 | H8 | 119.8° | 126.6° |
| C16 | C14 | C15 | H9 | 120.0° | 112.3° |
| C14 | C16 | C17 | H10 | 59.1° | 168.0° |
| C14 | C16 | C17 | H11 | 178.9° | 71.8° |
| C14 | C16 | N18 | H12 | 119.0° | 117.0° |
| C14 | C16 | C25 | H21 | 159.4° | 173.2° |
| C14 | C16 | C25 | H22 | 80.2° | 66.2° |
| C25 | C16 | C14 | C15 | 50.6° | 63.4° |
| C16 | C25 | N24 | H21 | 119.8° | 119.7° |
| C16 | C25 | N24 | H22 | 119.7° | 119.8° |
| C25 | C16 | N18 | C19 | 59.8° | 55.3° |
| C16 | C25 | N24 | C20 | 19.2° | 10.8° |
| C16 | C25 | N24 | C23 | 135.9° | 128.8° |
| C25 | C16 | C14 | H7 | 165.4° | 175.5° |
| C25 | C16 | C17 | H10 | 168.3° | 46.8° |
| C25 | C16 | C17 | H11 | 48.6° | 167.0° |
| C25 | C16 | N18 | H12 | 120.2° | 124.7° |
| C16 | C25 | H21 | H22 | 120.7° | 120.5° |
| N18 | C16 | C14 | C15 | 58.6° | 53.7° |
| N18 | C16 | C25 | N24 | 73.7° | 64.9° |
| C16 | N18 | C19 | H12 | 180.0° | 179.9° |
| C16 | N18 | C19 | C20 | 4.1° | 5.9° |
| C16 | N18 | C19 | O26 | 175.7° | 174.1° |
| N18 | C16 | C14 | H7 | 56.2° | 67.5° |
| N18 | C16 | C17 | H10 | 55.1° | 71.1° |
| N18 | C16 | C17 | H11 | 64.7° | 49.1° |
| N18 | C16 | C25 | H21 | 46.1° | 54.7° |
| N18 | C16 | C25 | H22 | 166.6° | 175.3° |
| C14 | C15 | C20 | H8 | 119.9° | 119.4° |
| C14 | C15 | C20 | H9 | 119.9° | 119.4° |
| C14 | C15 | C20 | N24 | 60.3° | 56.7° |
| C14 | C15 | C20 | C19 | 57.4° | 61.8° |
| C14 | C15 | C20 | C21 | 178.3° | 173.8° |
| C14 | C15 | H8 | H9 | 120.2° | 121.1° |
| C25 | N24 | C20 | C15 | 73.2° | 69.3° |
| C25 | N24 | C20 | C23 | 122.7° | 124.9° |
| C25 | N24 | C20 | C19 | 46.1° | 49.0° |
| C25 | N24 | C20 | C21 | 163.8° | 167.2° |
| C25 | N24 | C23 | C22 | 152.8° | 162.7° |
| C25 | N24 | C23 | H15 | 33.5° | 78.6° |
| C25 | N24 | C23 | H16 | 88.0° | 44.1° |
| N24 | C25 | H21 | H22 | 120.8° | 120.5° |
| N18 | C19 | C20 | C15 | 57.8° | 57.4° |
| N18 | C19 | C20 | N24 | 62.0° | 60.9° |
| N18 | C19 | C20 | O26 | 179.9° | 180.0° |
| N18 | C19 | C20 | C21 | 176.2° | 175.6° |
| C15 | C20 | N24 | C19 | 119.2° | 118.3° |
| C15 | C20 | N24 | C21 | 123.0° | 123.5° |
| C15 | C20 | N24 | C23 | 164.1° | 165.8° |
| C15 | C20 | C19 | C21 | 126.0° | 127.0° |
| C15 | C20 | C19 | O26 | 122.3° | 122.6° |
| C15 | C20 | C21 | C22 | 153.1° | 145.6° |
| C20 | C15 | C14 | H7 | 114.4° | 128.6° |
| C20 | C15 | H8 | H9 | 120.2° | 121.2° |
| C15 | C20 | C21 | H13 | 34.1° | 26.9° |
| C15 | C20 | C21 | H14 | 87.9° | 95.8° |
| N24 | C20 | C19 | C21 | 114.1° | 114.7° |
| N24 | C20 | C19 | O26 | 117.8° | 119.1° |
| C20 | N24 | C23 | C22 | 32.4° | 40.7° |
| N24 | C20 | C21 | C22 | 32.1° | 26.3° |
| N24 | C20 | C15 | H8 | 59.6° | 62.7° |
| N24 | C20 | C15 | H9 | 179.7° | 176.1° |
| N24 | C20 | C21 | H13 | 86.9° | 92.4° |
| N24 | C20 | C21 | H14 | 151.1° | 144.9° |
| C20 | N24 | C23 | H15 | 86.8° | 159.4° |
| C20 | N24 | C23 | H16 | 151.7° | 77.9° |
| C20 | N24 | C25 | H21 | 100.6° | 108.9° |
| C20 | N24 | C25 | H22 | 138.9° | 130.6° |
| C23 | N24 | C20 | C19 | 76.7° | 75.9° |
| C23 | N24 | C20 | C21 | 41.1° | 42.4° |
| N24 | C23 | C22 | H15 | 119.2° | 118.6° |
| N24 | C23 | C22 | H16 | 119.3° | 118.7° |
| N24 | C23 | C22 | C21 | 12.6° | 23.7° |
| N24 | C23 | H15 | H16 | 122.2° | 122.8° |
| N24 | C23 | C22 | H19 | 132.2° | 95.1° |
| N24 | C23 | C22 | H20 | 107.1° | 142.6° |
| C23 | N24 | C25 | H21 | 16.1° | 9.1° |
| C23 | N24 | C25 | H22 | 104.4° | 111.5° |
| C19 | C20 | C21 | C22 | 83.2° | 91.0° |
| C19 | C20 | C15 | H8 | 177.3° | 178.8° |
| C19 | C20 | C15 | H9 | 62.5° | 57.5° |
| C20 | C19 | N18 | H12 | 175.9° | 174.0° |
| C19 | C20 | C21 | H13 | 157.8° | 150.3° |
| C19 | C20 | C21 | H14 | 35.8° | 27.6° |
| O26 | C19 | C20 | C21 | 3.7° | 4.4° |
| O26 | C19 | N18 | H12 | 4.3° | 6.0° |
| C20 | C21 | C22 | C23 | 11.9° | 1.6° |
| C20 | C21 | C22 | H13 | 119.0° | 118.7° |
| C20 | C21 | C22 | H14 | 119.0° | 118.7° |
| C21 | C20 | C15 | H8 | 58.4° | 54.5° |
| C21 | C20 | C15 | H9 | 61.8° | 66.8° |
| C20 | C21 | H13 | H14 | 122.9° | 122.6° |
| C20 | C21 | C22 | H19 | 107.7° | 120.4° |
| C20 | C21 | C22 | H20 | 131.5° | 117.3° |
| C23 | C22 | C21 | H19 | 119.6° | 118.8° |
| C23 | C22 | C21 | H20 | 119.6° | 118.9° |
| C23 | C22 | C21 | H13 | 107.1° | 117.1° |
| C23 | C22 | C21 | H14 | 130.9° | 120.2° |
| C22 | C23 | H15 | H16 | 122.2° | 122.7° |
| C23 | C22 | H19 | H20 | 121.2° | 122.3° |
| C22 | C21 | H13 | H14 | 122.9° | 122.5° |
| C21 | C22 | C23 | H15 | 106.7° | 142.3° |
| C21 | C22 | C23 | H16 | 131.8° | 95.0° |
| C21 | C22 | H19 | H20 | 121.1° | 122.3° |
| H1 | C12 | H2 | H3 | 120.0° | 120.0° |
| H4 | C13 | H5 | H6 | 120.0° | 120.0° |
| H7 | C14 | C15 | H8 | 125.7° | 111.9° |
| H7 | C14 | C15 | H9 | 5.5° | 9.2° |
| H13 | C21 | C22 | H19 | 133.3° | 1.7° |
| H13 | C21 | C22 | H20 | 12.5° | 124.0° |
| H14 | C21 | C22 | H19 | 11.3° | 120.9° |
| H14 | C21 | C22 | H20 | 109.5° | 1.4° |
| H15 | C23 | C22 | H19 | 12.9° | 23.5° |
| H15 | C23 | C22 | H20 | 133.7° | 98.8° |
| H16 | C23 | C22 | H19 | 108.5° | 146.1° |
| H16 | C23 | C22 | H20 | 12.2° | 23.8° |
