A1BFE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C4 | sing | 1.53Å | 1.53Å | |
| C2 | C5 | sing | 1.53Å | 1.55Å | |
| C5 | N1 | sing | 1.47Å | 1.47Å | |
| N1 | C6 | sing | 1.35Å | 1.33Å | |
| C6 | O1 | doub | 1.21Å | 1.21Å | |
| C6 | C7 | sing | 1.51Å | 1.53Å | |
| C7 | F1 | sing | 1.40Å | 1.33Å | |
| C7 | F2 | sing | 1.40Å | 1.31Å | |
| C7 | F3 | sing | 1.40Å | 1.30Å | |
| C5 | C8 | sing | 1.51Å | 1.53Å | |
| C8 | O2 | doub | 1.21Å | 1.24Å | |
| C8 | N2 | sing | 1.35Å | 1.35Å | |
| N2 | C9 | sing | 1.47Å | 1.47Å | |
| C9 | C10 | sing | 1.51Å | 1.50Å | |
| C10 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.51Å | 1.50Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.51Å | 1.53Å | |
| C18 | O3 | doub | 1.21Å | 1.23Å | |
| C18 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C19 | sing | 1.47Å | 1.44Å | |
| C19 | C20 | sing | 1.51Å | 1.52Å | |
| C20 | N4 | doub | 1.28Å | 1.29Å | |
| C19 | C21 | sing | 1.53Å | 1.52Å | |
| C21 | C22 | sing | 1.53Å | 1.48Å | |
| C22 | C23 | sing | 1.55Å | 1.52Å | |
| C23 | C24 | sing | 1.54Å | 1.52Å | |
| C24 | N5 | sing | 1.47Å | 1.45Å | |
| N5 | C25 | sing | 1.34Å | 1.33Å | |
| C25 | O4 | doub | 1.21Å | 1.24Å | |
| N2 | C17 | sing | 1.47Å | 1.46Å | |
| C22 | C25 | sing | 1.51Å | 1.52Å | |
| C10 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.08Å | 1.08Å | |
| C13 | H16 | sing | 1.08Å | 1.08Å | |
| N1 | H11 | sing | 0.97Å | 1.00Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| N3 | H21 | sing | 0.97Å | 1.00Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H31 | sing | 1.09Å | 1.10Å | |
| C24 | H30 | sing | 1.09Å | 1.10Å | |
| N4 | H24 | sing | 0.97Å | 1.00Å | |
| N5 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 109.5° | 109.4° |
| C1 | C2 | C4 | 109.0° | 109.5° |
| C1 | C2 | C5 | 106.7° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.4° | 109.5° |
| C3 | C2 | C4 | 110.1° | 109.5° |
| C3 | C2 | C5 | 112.8° | 109.4° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C4 | C2 | C5 | 108.6° | 109.5° |
| C2 | C4 | H8 | 109.5° | 109.5° |
| C2 | C4 | H9 | 109.5° | 109.5° |
| C2 | C4 | H7 | 109.5° | 109.5° |
| C2 | C5 | N1 | 114.1° | 109.4° |
| C2 | C5 | C8 | 113.9° | 109.5° |
| C2 | C5 | H10 | 107.5° | 109.5° |
| C5 | N1 | C6 | 121.2° | 120.0° |
| N1 | C5 | C8 | 105.1° | 109.5° |
| N1 | C5 | H10 | 108.4° | 109.4° |
| C5 | N1 | H11 | 119.4° | 120.0° |
| N1 | C6 | O1 | 125.9° | 120.0° |
| N1 | C6 | C7 | 116.1° | 120.0° |
| C6 | N1 | H11 | 119.4° | 120.0° |
| O1 | C6 | C7 | 118.0° | 120.0° |
| C6 | C7 | F1 | 112.4° | 109.5° |
| C6 | C7 | F2 | 112.0° | 109.5° |
| C6 | C7 | F3 | 114.1° | 109.5° |
| F1 | C7 | F2 | 107.9° | 109.4° |
| F1 | C7 | F3 | 106.2° | 109.5° |
| F2 | C7 | F3 | 103.6° | 109.5° |
| C5 | C8 | O2 | 118.0° | 120.0° |
| C5 | C8 | N2 | 119.8° | 120.0° |
| C8 | C5 | H10 | 107.7° | 109.5° |
| O2 | C8 | N2 | 122.2° | 120.0° |
| C8 | N2 | C9 | 126.9° | 121.3° |
| C8 | N2 | C17 | 115.6° | 121.3° |
| N2 | C9 | C10 | 107.5° | 109.6° |
| C9 | N2 | C17 | 117.5° | 117.4° |
| N2 | C9 | H12 | 110.0° | 109.4° |
| N2 | C9 | H13 | 110.0° | 109.4° |
| C9 | C10 | C11 | 123.2° | 117.8° |
| C9 | C10 | C15 | 116.8° | 122.4° |
| C10 | C9 | H12 | 110.0° | 109.5° |
| C10 | C9 | H13 | 110.0° | 109.4° |
| C10 | C11 | C12 | 120.3° | 120.5° |
| C11 | C10 | C15 | 119.9° | 119.8° |
| C10 | C11 | H14 | 119.9° | 119.7° |
| C11 | C12 | C13 | 120.1° | 119.7° |
| C12 | C11 | H14 | 119.9° | 119.8° |
| C11 | C12 | H15 | 119.9° | 120.2° |
| C12 | C13 | C14 | 119.8° | 119.8° |
| C13 | C12 | H15 | 119.9° | 120.1° |
| C12 | C13 | H16 | 120.1° | 120.1° |
| C13 | C14 | C15 | 120.7° | 120.6° |
| C13 | C14 | H17 | 119.7° | 119.7° |
| C14 | C13 | H16 | 120.1° | 120.1° |
| C14 | C15 | C16 | 124.5° | 117.6° |
| C14 | C15 | C10 | 119.2° | 119.5° |
| C15 | C14 | H17 | 119.7° | 119.7° |
| C15 | C16 | C17 | 112.2° | 110.9° |
| C16 | C15 | C10 | 116.3° | 122.8° |
| C15 | C16 | H18 | 108.8° | 109.2° |
| C15 | C16 | H19 | 108.8° | 109.2° |
| C16 | C17 | C18 | 109.5° | 109.8° |
| C16 | C17 | N2 | 111.8° | 107.9° |
| C17 | C16 | H18 | 108.8° | 109.2° |
| C17 | C16 | H19 | 108.8° | 109.2° |
| C16 | C17 | H20 | 108.3° | 109.7° |
| C17 | C18 | O3 | 120.6° | 120.0° |
| C17 | C18 | N3 | 115.1° | 120.0° |
| C18 | C17 | N2 | 109.8° | 109.8° |
| C18 | C17 | H20 | 108.2° | 109.8° |
| O3 | C18 | N3 | 124.3° | 120.0° |
| C18 | N3 | C19 | 121.5° | 120.0° |
| C18 | N3 | H21 | 119.3° | 120.0° |
| N3 | C19 | C20 | 112.2° | 109.5° |
| N3 | C19 | C21 | 112.0° | 109.5° |
| C19 | N3 | H21 | 119.3° | 120.0° |
| N3 | C19 | H22 | 109.3° | 109.5° |
| C19 | C20 | N4 | 126.5° | 120.0° |
| C20 | C19 | C21 | 106.7° | 109.5° |
| C20 | C19 | H22 | 108.3° | 109.5° |
| C19 | C20 | H23 | 116.7° | 120.0° |
| N4 | C20 | H23 | 116.7° | 120.0° |
| C20 | N4 | H24 | 112.0° | 120.0° |
| C19 | C21 | C22 | 112.7° | 109.5° |
| C21 | C19 | H22 | 108.3° | 109.5° |
| C19 | C21 | H25 | 108.7° | 109.5° |
| C19 | C21 | H26 | 108.7° | 109.5° |
| C21 | C22 | C23 | 131.5° | 110.5° |
| C21 | C22 | C25 | 116.7° | 110.5° |
| C22 | C21 | H25 | 108.7° | 109.4° |
| C22 | C21 | H26 | 108.7° | 109.4° |
| C21 | C22 | H27 | 98.6° | 110.4° |
| C22 | C23 | C24 | 105.8° | 101.8° |
| C23 | C22 | C25 | 105.2° | 104.2° |
| C23 | C22 | H27 | 98.4° | 110.5° |
| C22 | C23 | H29 | 110.4° | 111.0° |
| C22 | C23 | H28 | 110.4° | 110.9° |
| C23 | C24 | N5 | 104.0° | 105.5° |
| C24 | C23 | H29 | 110.4° | 111.0° |
| C24 | C23 | H28 | 110.4° | 111.0° |
| C23 | C24 | H31 | 110.8° | 110.3° |
| C23 | C24 | H30 | 110.8° | 110.3° |
| C24 | N5 | C25 | 113.9° | 111.3° |
| N5 | C24 | H31 | 110.8° | 110.2° |
| N5 | C24 | H30 | 110.8° | 110.3° |
| C24 | N5 | H32 | 123.0° | 124.3° |
| N5 | C25 | O4 | 125.8° | 124.9° |
| N5 | C25 | C22 | 108.1° | 110.1° |
| C25 | N5 | H32 | 123.0° | 124.4° |
| O4 | C25 | C22 | 125.7° | 125.0° |
| N2 | C17 | H20 | 109.1° | 109.8° |
| C25 | C22 | H27 | 98.3° | 110.6° |
| H8 | C4 | H9 | 109.4° | 109.4° |
| H8 | C4 | H7 | 109.5° | 109.5° |
| H9 | C4 | H7 | 109.5° | 109.5° |
| H12 | C9 | H13 | 109.5° | 109.5° |
| H6 | C3 | H4 | 109.4° | 109.5° |
| H6 | C3 | H5 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.4° | 109.4° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H3 | C1 | H2 | 109.5° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H18 | C16 | H19 | 109.5° | 109.1° |
| H25 | C21 | H26 | 109.4° | 109.5° |
| H29 | C23 | H28 | 109.5° | 110.8° |
| H31 | C24 | H30 | 109.5° | 110.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C4 | 119.8° | 120.0° |
| C1 | C2 | C3 | C5 | 118.7° | 120.0° |
| C1 | C2 | C4 | C5 | 115.9° | 120.1° |
| C1 | C2 | C5 | N1 | 177.1° | 36.6° |
| C1 | C2 | C5 | C8 | 62.2° | 83.4° |
| C1 | C2 | C4 | H8 | 180.0° | 57.0° |
| C1 | C2 | C4 | H9 | 60.0° | 177.0° |
| C1 | C2 | C4 | H7 | 60.0° | 63.0° |
| C1 | C2 | C5 | H10 | 56.9° | 156.6° |
| C1 | C2 | C3 | H6 | 180.0° | 64.5° |
| C1 | C2 | C3 | H4 | 60.0° | 175.4° |
| C1 | C2 | C3 | H5 | 60.0° | 55.5° |
| C2 | C1 | H3 | H1 | 120.0° | 120.0° |
| C2 | C1 | H3 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C3 | C2 | C4 | C5 | 123.9° | 120.0° |
| C3 | C2 | C5 | N1 | 62.5° | 156.6° |
| C3 | C2 | C5 | C8 | 58.1° | 36.6° |
| C3 | C2 | C4 | H8 | 59.8° | 62.9° |
| C3 | C2 | C4 | H9 | 60.1° | 57.0° |
| C3 | C2 | C4 | H7 | 179.8° | 177.0° |
| C3 | C2 | C5 | H10 | 177.2° | 83.5° |
| C2 | C3 | H6 | H4 | 120.0° | 120.0° |
| C2 | C3 | H6 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C3 | C2 | C1 | H3 | 180.0° | 60.0° |
| C3 | C2 | C1 | H1 | 60.0° | 180.0° |
| C3 | C2 | C1 | H2 | 60.0° | 60.0° |
| C4 | C2 | C5 | N1 | 59.8° | 83.4° |
| C4 | C2 | C5 | C8 | 179.6° | 156.6° |
| C2 | C4 | H8 | H9 | 120.0° | 120.0° |
| C2 | C4 | H8 | H7 | 120.0° | 120.1° |
| C2 | C4 | H9 | H7 | 120.0° | 120.0° |
| C4 | C2 | C5 | H10 | 60.5° | 36.5° |
| C4 | C2 | C3 | H6 | 60.2° | 175.5° |
| C4 | C2 | C3 | H4 | 179.8° | 55.5° |
| C4 | C2 | C3 | H5 | 59.9° | 64.5° |
| C4 | C2 | C1 | H3 | 59.5° | 60.0° |
| C4 | C2 | C1 | H1 | 60.5° | 60.0° |
| C4 | C2 | C1 | H2 | 179.5° | 180.0° |
| C2 | C5 | N1 | C8 | 125.4° | 120.0° |
| C2 | C5 | N1 | H10 | 119.7° | 120.0° |
| C2 | C5 | N1 | C6 | 127.0° | 85.0° |
| C2 | C5 | C8 | H10 | 119.0° | 120.0° |
| C2 | C5 | C8 | O2 | 75.2° | 123.1° |
| C2 | C5 | C8 | N2 | 104.1° | 56.8° |
| C5 | C2 | C4 | H8 | 64.1° | 177.1° |
| C5 | C2 | C4 | H9 | 175.9° | 62.9° |
| C5 | C2 | C4 | H7 | 55.9° | 57.1° |
| C2 | C5 | N1 | H11 | 53.0° | 95.0° |
| C5 | C2 | C3 | H6 | 61.3° | 55.5° |
| C5 | C2 | C3 | H4 | 58.7° | 64.5° |
| C5 | C2 | C3 | H5 | 178.6° | 175.5° |
| C5 | C2 | C1 | H3 | 57.6° | 179.9° |
| C5 | C2 | C1 | H1 | 177.6° | 60.0° |
| C5 | C2 | C1 | H2 | 62.4° | 59.9° |
| C5 | N1 | C6 | H11 | 180.0° | 180.0° |
| C5 | N1 | C6 | O1 | 3.3° | 0.0° |
| C5 | N1 | C6 | C7 | 175.4° | 180.0° |
| N1 | C5 | C8 | H10 | 115.4° | 120.0° |
| N1 | C5 | C8 | O2 | 50.3° | 3.2° |
| N1 | C5 | C8 | N2 | 130.4° | 176.8° |
| N1 | C6 | O1 | C7 | 178.7° | 180.0° |
| N1 | C6 | C7 | F1 | 175.5° | 180.0° |
| N1 | C6 | C7 | F2 | 62.9° | 60.0° |
| N1 | C6 | C7 | F3 | 54.4° | 60.0° |
| C6 | N1 | C5 | C8 | 107.6° | 155.0° |
| C6 | N1 | C5 | H10 | 7.3° | 35.0° |
| O1 | C6 | C7 | F1 | 5.7° | 0.1° |
| O1 | C6 | C7 | F2 | 116.0° | 120.0° |
| O1 | C6 | C7 | F3 | 126.7° | 120.0° |
| O1 | C6 | N1 | H11 | 176.7° | 180.0° |
| C6 | C7 | F1 | F2 | 124.0° | 120.0° |
| C6 | C7 | F1 | F3 | 125.4° | 120.0° |
| C6 | C7 | F2 | F3 | 123.4° | 120.0° |
| C7 | C6 | N1 | H11 | 4.6° | 0.0° |
| F1 | C7 | F2 | F3 | 112.4° | 120.0° |
| C5 | C8 | O2 | N2 | 179.2° | 180.0° |
| C5 | C8 | N2 | C9 | 1.8° | 135.6° |
| C5 | C8 | N2 | C17 | 178.0° | 44.4° |
| C8 | C5 | N1 | H11 | 72.4° | 25.0° |
| O2 | C8 | N2 | C9 | 179.0° | 44.3° |
| O2 | C8 | N2 | C17 | 1.2° | 135.6° |
| O2 | C8 | C5 | H10 | 165.8° | 116.8° |
| C8 | N2 | C9 | C17 | 179.8° | 179.9° |
| C8 | N2 | C9 | C10 | 124.6° | 135.6° |
| C8 | N2 | C17 | C16 | 165.9° | 115.7° |
| C8 | N2 | C17 | C18 | 72.3° | 3.9° |
| N2 | C8 | C5 | H10 | 15.0° | 63.2° |
| C8 | N2 | C9 | H12 | 4.9° | 15.5° |
| C8 | N2 | C9 | H13 | 115.7° | 104.5° |
| C8 | N2 | C17 | H20 | 46.2° | 124.7° |
| N2 | C9 | C10 | H12 | 119.7° | 120.1° |
| N2 | C9 | C10 | H13 | 119.7° | 120.0° |
| N2 | C9 | C10 | C11 | 131.2° | 168.5° |
| C9 | N2 | C17 | C16 | 14.2° | 64.2° |
| C9 | N2 | C17 | C18 | 107.5° | 176.2° |
| N2 | C9 | C10 | C15 | 46.0° | 11.5° |
| N2 | C9 | H12 | H13 | 120.9° | 119.9° |
| C9 | N2 | C17 | H20 | 134.0° | 55.4° |
| C9 | C10 | C11 | C15 | 177.2° | 180.0° |
| C9 | C10 | C11 | C12 | 178.8° | 179.0° |
| C9 | C10 | C15 | C14 | 179.0° | 179.3° |
| C9 | C10 | C15 | C16 | 3.5° | 1.5° |
| C10 | C9 | N2 | C17 | 55.6° | 44.4° |
| C9 | C10 | C11 | H14 | 1.2° | 0.2° |
| C10 | C9 | H12 | H13 | 120.9° | 119.9° |
| C10 | C11 | C12 | H14 | 180.0° | 179.1° |
| C10 | C11 | C12 | C13 | 0.6° | 0.8° |
| C11 | C10 | C15 | C14 | 1.6° | 0.7° |
| C11 | C10 | C15 | C16 | 179.2° | 178.6° |
| C11 | C10 | C9 | H12 | 11.5° | 48.4° |
| C11 | C10 | C9 | H13 | 109.1° | 71.6° |
| C10 | C11 | C12 | H15 | 179.4° | 180.0° |
| C11 | C12 | C13 | H15 | 180.0° | 179.2° |
| C11 | C12 | C13 | C14 | 0.4° | 0.3° |
| C12 | C11 | C10 | C15 | 1.7° | 1.0° |
| C11 | C12 | C13 | H16 | 179.5° | 179.7° |
| C12 | C13 | C14 | H16 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 0.5° | 0.0° |
| C12 | C13 | C14 | H17 | 179.5° | 179.6° |
| C13 | C12 | C11 | H14 | 179.4° | 179.9° |
| C13 | C14 | C15 | H17 | 180.0° | 179.6° |
| C13 | C14 | C15 | C16 | 177.9° | 179.1° |
| C13 | C14 | C15 | C10 | 0.6° | 0.2° |
| C14 | C13 | C12 | H15 | 179.6° | 179.5° |
| C14 | C15 | C16 | C10 | 177.4° | 179.3° |
| C14 | C15 | C16 | C17 | 135.8° | 160.6° |
| C15 | C14 | C13 | H16 | 179.5° | 180.0° |
| C14 | C15 | C16 | H18 | 15.4° | 40.2° |
| C14 | C15 | C16 | H19 | 103.8° | 79.1° |
| C15 | C16 | C17 | H18 | 120.4° | 120.4° |
| C15 | C16 | C17 | H19 | 120.4° | 120.4° |
| C15 | C16 | C17 | C18 | 158.7° | 167.1° |
| C15 | C16 | C17 | N2 | 36.7° | 47.4° |
| C16 | C15 | C14 | H17 | 2.1° | 1.3° |
| C15 | C16 | H18 | H19 | 118.8° | 119.4° |
| C15 | C16 | C17 | H20 | 83.5° | 72.1° |
| C16 | C17 | C18 | N2 | 123.1° | 118.5° |
| C16 | C17 | C18 | H20 | 117.8° | 120.7° |
| C16 | C17 | C18 | O3 | 88.5° | 162.8° |
| C16 | C17 | C18 | N3 | 91.3° | 17.2° |
| C16 | C17 | N2 | H20 | 119.8° | 119.6° |
| C17 | C16 | C15 | C10 | 46.8° | 20.1° |
| C17 | C16 | H18 | H19 | 118.8° | 119.3° |
| C17 | C18 | O3 | N3 | 179.8° | 180.0° |
| C17 | C18 | N3 | C19 | 173.2° | 177.9° |
| C18 | C17 | N2 | H20 | 118.5° | 120.8° |
| C17 | C18 | N3 | H21 | 6.8° | 2.0° |
| C18 | C17 | C16 | H18 | 80.9° | 72.5° |
| C18 | C17 | C16 | H19 | 38.3° | 46.7° |
| O3 | C18 | N3 | C19 | 6.6° | 2.1° |
| O3 | C18 | C17 | N2 | 34.6° | 78.7° |
| O3 | C18 | N3 | H21 | 173.4° | 177.9° |
| O3 | C18 | C17 | H20 | 153.7° | 42.0° |
| C18 | N3 | C19 | H21 | 180.0° | 180.0° |
| C18 | N3 | C19 | C20 | 123.8° | 130.0° |
| C18 | N3 | C19 | C21 | 116.3° | 110.0° |
| N3 | C18 | C17 | N2 | 145.5° | 101.3° |
| N3 | C18 | C17 | H20 | 26.5° | 138.0° |
| C18 | N3 | C19 | H22 | 3.7° | 10.0° |
| N3 | C19 | C20 | C21 | 123.0° | 120.0° |
| N3 | C19 | C20 | H22 | 120.7° | 120.0° |
| N3 | C19 | C20 | N4 | 141.6° | 0.0° |
| N3 | C19 | C21 | H22 | 120.6° | 120.0° |
| N3 | C19 | C21 | C22 | 78.6° | 57.8° |
| N3 | C19 | C20 | H23 | 38.4° | 180.0° |
| N3 | C19 | C21 | H25 | 41.9° | 62.2° |
| N3 | C19 | C21 | H26 | 160.9° | 177.8° |
| C19 | C20 | N4 | H23 | 180.0° | 180.0° |
| C20 | C19 | C21 | H22 | 116.4° | 120.0° |
| C20 | C19 | C21 | C22 | 158.4° | 177.8° |
| C20 | C19 | N3 | H21 | 56.2° | 50.0° |
| C20 | C19 | C21 | H25 | 81.1° | 57.8° |
| C20 | C19 | C21 | H26 | 37.9° | 62.2° |
| C19 | C20 | N4 | H24 | 180.0° | 180.0° |
| N4 | C20 | C19 | C21 | 95.4° | 120.0° |
| N4 | C20 | C19 | H22 | 21.0° | 120.0° |
| C19 | C21 | C22 | H25 | 120.5° | 120.0° |
| C19 | C21 | C22 | H26 | 120.5° | 120.0° |
| C19 | C21 | C22 | C23 | 41.5° | 62.6° |
| C19 | C21 | C22 | C25 | 171.7° | 177.3° |
| C21 | C19 | N3 | H21 | 63.7° | 70.0° |
| C21 | C19 | C20 | H23 | 84.6° | 60.0° |
| C19 | C21 | H25 | H26 | 118.5° | 120.1° |
| C19 | C21 | C22 | H27 | 67.8° | 60.0° |
| C21 | C22 | C23 | C25 | 149.5° | 118.7° |
| C21 | C22 | C23 | H27 | 109.4° | 122.5° |
| C21 | C22 | C23 | C24 | 156.1° | 143.5° |
| C21 | C22 | C25 | N5 | 150.5° | 134.9° |
| C21 | C22 | C25 | O4 | 22.1° | 45.1° |
| C21 | C22 | C25 | H27 | 104.1° | 122.6° |
| C22 | C21 | C19 | H22 | 42.0° | 62.2° |
| C22 | C21 | H25 | H26 | 118.5° | 119.9° |
| C21 | C22 | C23 | H29 | 36.7° | 25.3° |
| C21 | C22 | C23 | H28 | 84.4° | 98.4° |
| C22 | C23 | C24 | H29 | 119.4° | 118.2° |
| C22 | C23 | C24 | H28 | 119.4° | 118.1° |
| C22 | C23 | C24 | N5 | 14.3° | 25.5° |
| C23 | C22 | C25 | N5 | 4.3° | 16.3° |
| C23 | C22 | C25 | O4 | 176.9° | 163.8° |
| C23 | C22 | C25 | H27 | 101.1° | 118.8° |
| C23 | C22 | C21 | H25 | 162.0° | 177.4° |
| C23 | C22 | C21 | H26 | 79.0° | 57.4° |
| C22 | C23 | H29 | H28 | 121.7° | 123.8° |
| C22 | C23 | C24 | H31 | 133.4° | 144.4° |
| C22 | C23 | C24 | H30 | 104.8° | 93.6° |
| C23 | C24 | N5 | H31 | 119.2° | 119.0° |
| C23 | C24 | N5 | H30 | 119.1° | 119.1° |
| C23 | C24 | N5 | C25 | 18.7° | 17.0° |
| C24 | C23 | C22 | C25 | 6.6° | 24.8° |
| C24 | C23 | C22 | H27 | 94.5° | 94.0° |
| C24 | C23 | H29 | H28 | 121.7° | 123.8° |
| C23 | C24 | H31 | H30 | 122.5° | 122.0° |
| C23 | C24 | N5 | H32 | 161.3° | 163.0° |
| C24 | N5 | C25 | H32 | 180.0° | 180.0° |
| C24 | N5 | C25 | O4 | 172.7° | 179.5° |
| C24 | N5 | C25 | C22 | 14.7° | 0.4° |
| N5 | C24 | C23 | H29 | 105.1° | 92.7° |
| N5 | C24 | C23 | H28 | 133.7° | 143.6° |
| N5 | C24 | H31 | H30 | 122.5° | 122.0° |
| N5 | C25 | O4 | C22 | 171.3° | 179.9° |
| N5 | C25 | C22 | H27 | 105.4° | 102.5° |
| C25 | N5 | C24 | H31 | 137.8° | 136.0° |
| C25 | N5 | C24 | H30 | 100.4° | 102.0° |
| O4 | C25 | C22 | H27 | 82.0° | 77.4° |
| O4 | C25 | N5 | H32 | 7.3° | 0.5° |
| C17 | N2 | C9 | H12 | 175.3° | 164.4° |
| C17 | N2 | C9 | H13 | 64.1° | 75.6° |
| N2 | C17 | C16 | H18 | 157.1° | 167.8° |
| N2 | C17 | C16 | H19 | 83.7° | 72.9° |
| C25 | C22 | C21 | H25 | 51.2° | 62.6° |
| C25 | C22 | C21 | H26 | 67.8° | 57.3° |
| C25 | C22 | C23 | H29 | 112.8° | 93.4° |
| C25 | C22 | C23 | H28 | 126.1° | 143.0° |
| C22 | C25 | N5 | H32 | 165.3° | 179.6° |
| C10 | C15 | C14 | H17 | 179.4° | 179.4° |
| C15 | C10 | C11 | H14 | 178.4° | 179.9° |
| C15 | C10 | C9 | H12 | 165.7° | 131.6° |
| C15 | C10 | C9 | H13 | 73.7° | 108.4° |
| C10 | C15 | C16 | H18 | 167.2° | 140.5° |
| C10 | C15 | C16 | H19 | 73.6° | 100.2° |
| H8 | C4 | H9 | H7 | 120.0° | 120.0° |
| H17 | C14 | C13 | H16 | 0.5° | 0.4° |
| H10 | C5 | N1 | H11 | 172.7° | 145.0° |
| H14 | C11 | C12 | H15 | 0.6° | 0.9° |
| H15 | C12 | C13 | H16 | 0.4° | 0.5° |
| H6 | C3 | H4 | H5 | 120.0° | 120.0° |
| H21 | N3 | C19 | H22 | 176.3° | 170.0° |
| H3 | C1 | H1 | H2 | 120.0° | 119.9° |
| H18 | C16 | C17 | H20 | 36.8° | 48.3° |
| H19 | C16 | C17 | H20 | 156.1° | 167.5° |
| H22 | C19 | C20 | H23 | 159.1° | 60.0° |
| H22 | C19 | C21 | H25 | 162.5° | 177.8° |
| H22 | C19 | C21 | H26 | 78.5° | 57.8° |
| H23 | C20 | N4 | H24 | 0.0° | 0.0° |
| H25 | C21 | C22 | H27 | 52.7° | 60.1° |
| H26 | C21 | C22 | H27 | 171.7° | 180.0° |
| H27 | C22 | C23 | H29 | 146.1° | 147.8° |
| H27 | C22 | C23 | H28 | 25.0° | 24.1° |
| H29 | C23 | C24 | H31 | 14.0° | 26.3° |
| H29 | C23 | C24 | H30 | 135.7° | 148.2° |
| H28 | C23 | C24 | H31 | 107.1° | 97.5° |
| H28 | C23 | C24 | H30 | 14.6° | 24.5° |
| H31 | C24 | N5 | H32 | 42.2° | 44.0° |
| H30 | C24 | N5 | H32 | 79.6° | 78.0° |
