7KC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | N25 | sing | 1.47Å | 1.48Å | |
| N25 | C26 | sing | 1.47Å | 1.50Å | |
| N25 | C24 | sing | 1.47Å | 1.51Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| O21 | C20 | doub | 1.22Å | 1.23Å | |
| C23 | C28 | sing | 1.51Å | 1.39Å | |
| C23 | N22 | sing | 1.46Å | 1.47Å | |
| C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C33 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | N22 | sing | 1.35Å | 1.34Å | |
| C20 | N18 | sing | 1.35Å | 1.35Å | |
| C34 | C19 | sing | 1.53Å | 1.55Å | |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C19 | sing | 1.53Å | 1.53Å | |
| N18 | C19 | sing | 1.47Å | 1.50Å | |
| N18 | C17 | sing | 1.47Å | 1.34Å | |
| C19 | C14 | sing | 1.51Å | 1.41Å | |
| C17 | C13 | sing | 1.51Å | 1.34Å | |
| C14 | C13 | doub | 1.35Å | 1.34Å | Aromatic |
| C14 | N15 | sing | 1.35Å | 1.32Å | Aromatic |
| C13 | C12 | sing | 1.41Å | 1.36Å | Aromatic |
| N15 | N16 | sing | 1.40Å | 1.32Å | Aromatic |
| C12 | N16 | doub | 1.31Å | 1.31Å | Aromatic |
| C12 | N10 | sing | 1.40Å | 1.36Å | |
| C11 | C4 | sing | 1.51Å | 1.39Å | |
| N5 | C4 | doub | 1.32Å | 1.38Å | Aromatic |
| N5 | C6 | sing | 1.33Å | 1.40Å | Aromatic |
| C4 | N3 | sing | 1.31Å | 1.34Å | Aromatic |
| N10 | C6 | sing | 1.39Å | 1.35Å | |
| C6 | C1 | doub | 1.40Å | 1.35Å | Aromatic |
| N3 | C2 | doub | 1.35Å | 1.35Å | Aromatic |
| C1 | C2 | sing | 1.40Å | 1.36Å | Aromatic |
| C1 | S7 | sing | 1.76Å | 1.76Å | Aromatic |
| C2 | C9 | sing | 1.40Å | 1.35Å | Aromatic |
| S7 | C8 | sing | 1.76Å | 1.69Å | Aromatic |
| C9 | C8 | doub | 1.32Å | 1.35Å | Aromatic |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C9 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C27 | H9 | sing | 1.09Å | 1.10Å | |
| C27 | H10 | sing | 1.09Å | 1.10Å | |
| C27 | H11 | sing | 1.09Å | 1.10Å | |
| C30 | H12 | sing | 1.08Å | 1.08Å | |
| C31 | H13 | sing | 1.08Å | 1.08Å | |
| C32 | H14 | sing | 1.08Å | 1.08Å | |
| C33 | H15 | sing | 1.08Å | 1.08Å | |
| C34 | H16 | sing | 1.09Å | 1.10Å | |
| C34 | H17 | sing | 1.09Å | 1.10Å | |
| C34 | H18 | sing | 1.09Å | 1.10Å | |
| C35 | H19 | sing | 1.09Å | 1.10Å | |
| C35 | H20 | sing | 1.09Å | 1.10Å | |
| C35 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| N22 | H27 | sing | 0.97Å | 1.00Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| N15 | H30 | sing | 0.97Å | 1.00Å | |
| N10 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | N25 | C26 | 105.5° | 111.0° |
| C27 | N25 | C24 | 107.7° | 111.0° |
| N25 | C27 | H9 | 109.5° | 109.5° |
| N25 | C27 | H10 | 109.5° | 109.5° |
| N25 | C27 | H11 | 109.4° | 109.4° |
| C26 | N25 | C24 | 114.8° | 111.0° |
| N25 | C26 | H24 | 109.5° | 109.5° |
| N25 | C26 | H25 | 109.5° | 109.5° |
| N25 | C26 | H26 | 109.5° | 109.5° |
| N25 | C24 | C23 | 112.3° | 109.5° |
| N25 | C24 | H6 | 108.8° | 109.5° |
| N25 | C24 | H7 | 108.8° | 109.5° |
| C24 | C23 | C28 | 112.5° | 109.5° |
| C24 | C23 | N22 | 108.0° | 109.5° |
| C23 | C24 | H6 | 108.7° | 109.4° |
| C23 | C24 | H7 | 108.7° | 109.5° |
| C24 | C23 | H23 | 109.2° | 109.4° |
| C30 | C29 | C28 | 120.2° | 120.0° |
| C29 | C30 | C31 | 120.2° | 120.0° |
| C29 | C30 | H12 | 119.9° | 120.0° |
| C30 | C29 | H22 | 119.9° | 120.0° |
| C29 | C28 | C23 | 119.1° | 120.0° |
| C29 | C28 | C33 | 119.3° | 120.0° |
| C28 | C29 | H22 | 119.9° | 120.0° |
| O21 | C20 | N22 | 120.2° | 120.0° |
| O21 | C20 | N18 | 121.5° | 120.0° |
| C28 | C23 | N22 | 106.0° | 109.5° |
| C23 | C28 | C33 | 121.7° | 120.0° |
| C28 | C23 | H23 | 111.0° | 109.5° |
| C23 | N22 | C20 | 123.3° | 120.0° |
| N22 | C23 | H23 | 110.0° | 109.5° |
| C23 | N22 | H27 | 118.4° | 120.0° |
| C30 | C31 | C32 | 120.5° | 120.0° |
| C31 | C30 | H12 | 119.9° | 120.0° |
| C30 | C31 | H13 | 119.8° | 120.0° |
| C28 | C33 | C32 | 120.7° | 120.0° |
| C28 | C33 | H15 | 119.6° | 120.0° |
| N22 | C20 | N18 | 118.2° | 120.0° |
| C20 | N22 | H27 | 118.4° | 120.0° |
| C20 | N18 | C19 | 126.2° | 126.9° |
| C20 | N18 | C17 | 128.3° | 126.8° |
| C34 | C19 | C35 | 108.7° | 109.9° |
| C34 | C19 | N18 | 113.6° | 109.8° |
| C34 | C19 | C14 | 110.5° | 109.9° |
| C19 | C34 | H16 | 109.5° | 109.5° |
| C19 | C34 | H17 | 109.5° | 109.5° |
| C19 | C34 | H18 | 109.4° | 109.5° |
| C31 | C32 | C33 | 119.2° | 120.0° |
| C32 | C31 | H13 | 119.7° | 120.0° |
| C31 | C32 | H14 | 120.4° | 120.0° |
| C33 | C32 | H14 | 120.4° | 120.0° |
| C32 | C33 | H15 | 119.7° | 120.0° |
| C35 | C19 | N18 | 110.7° | 109.9° |
| C35 | C19 | C14 | 110.2° | 109.9° |
| C19 | C35 | H19 | 109.5° | 109.5° |
| C19 | C35 | H20 | 109.5° | 109.4° |
| C19 | C35 | H21 | 109.5° | 109.5° |
| C19 | N18 | C17 | 105.5° | 106.3° |
| N18 | C19 | C14 | 103.1° | 107.5° |
| N18 | C17 | C13 | 112.5° | 107.4° |
| N18 | C17 | H28 | 108.7° | 109.9° |
| N18 | C17 | H29 | 108.7° | 109.9° |
| C19 | C14 | C13 | 110.6° | 109.3° |
| C19 | C14 | N15 | 142.2° | 142.8° |
| C17 | C13 | C14 | 108.3° | 109.4° |
| C17 | C13 | C12 | 143.8° | 142.8° |
| C13 | C17 | H28 | 108.7° | 109.8° |
| C13 | C17 | H29 | 108.7° | 109.8° |
| C13 | C14 | N15 | 107.2° | 107.9° |
| C14 | C13 | C12 | 107.9° | 107.8° |
| C14 | N15 | N16 | 108.5° | 108.1° |
| C14 | N15 | H30 | 125.8° | 126.0° |
| C13 | C12 | N16 | 106.7° | 108.0° |
| C13 | C12 | N10 | 138.5° | 125.9° |
| N15 | N16 | C12 | 109.7° | 108.2° |
| N16 | N15 | H30 | 125.7° | 125.9° |
| N16 | C12 | N10 | 114.8° | 126.0° |
| C12 | N10 | C6 | 123.2° | 120.0° |
| C12 | N10 | H31 | 118.4° | 120.0° |
| C11 | C4 | N5 | 117.5° | 118.7° |
| C11 | C4 | N3 | 123.9° | 118.7° |
| C4 | C11 | H3 | 109.5° | 109.4° |
| C4 | C11 | H4 | 109.5° | 109.5° |
| C4 | C11 | H5 | 109.5° | 109.5° |
| C4 | N5 | C6 | 119.9° | 120.8° |
| N5 | C4 | N3 | 118.5° | 122.5° |
| N5 | C6 | N10 | 123.8° | 120.6° |
| N5 | C6 | C1 | 119.0° | 118.8° |
| C4 | N3 | C2 | 122.3° | 121.1° |
| N10 | C6 | C1 | 117.2° | 120.6° |
| C6 | N10 | H31 | 118.4° | 120.0° |
| C6 | C1 | C2 | 120.3° | 118.9° |
| C6 | C1 | S7 | 133.0° | 131.6° |
| N3 | C2 | C1 | 119.9° | 117.8° |
| N3 | C2 | C9 | 125.3° | 129.7° |
| C2 | C1 | S7 | 106.6° | 109.5° |
| C1 | C2 | C9 | 114.8° | 112.5° |
| C1 | S7 | C8 | 93.7° | 91.5° |
| C2 | C9 | C8 | 115.9° | 115.8° |
| C2 | C9 | H2 | 122.0° | 122.1° |
| S7 | C8 | C9 | 109.0° | 110.8° |
| S7 | C8 | H1 | 125.5° | 124.6° |
| C9 | C8 | H1 | 125.5° | 124.6° |
| C8 | C9 | H2 | 122.1° | 122.1° |
| H3 | C11 | H4 | 109.4° | 109.5° |
| H3 | C11 | H5 | 109.5° | 109.4° |
| H4 | C11 | H5 | 109.5° | 109.5° |
| H6 | C24 | H7 | 109.5° | 109.4° |
| H9 | C27 | H10 | 109.5° | 109.5° |
| H9 | C27 | H11 | 109.5° | 109.5° |
| H10 | C27 | H11 | 109.4° | 109.5° |
| H16 | C34 | H17 | 109.5° | 109.4° |
| H16 | C34 | H18 | 109.5° | 109.5° |
| H17 | C34 | H18 | 109.5° | 109.5° |
| H19 | C35 | H20 | 109.5° | 109.4° |
| H19 | C35 | H21 | 109.5° | 109.5° |
| H20 | C35 | H21 | 109.5° | 109.5° |
| H24 | C26 | H25 | 109.5° | 109.4° |
| H24 | C26 | H26 | 109.4° | 109.5° |
| H25 | C26 | H26 | 109.5° | 109.5° |
| H28 | C17 | H29 | 109.5° | 110.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | N25 | C26 | C24 | 118.4° | 124.0° |
| C27 | N25 | C24 | C23 | 159.6° | 160.1° |
| C27 | N25 | C24 | H6 | 39.2° | 79.9° |
| C27 | N25 | C24 | H7 | 80.0° | 40.1° |
| N25 | C27 | H9 | H10 | 120.0° | 120.0° |
| N25 | C27 | H9 | H11 | 120.0° | 120.0° |
| N25 | C27 | H10 | H11 | 120.0° | 120.0° |
| C27 | N25 | C26 | H24 | 180.0° | 179.6° |
| C27 | N25 | C26 | H25 | 60.0° | 60.4° |
| C27 | N25 | C26 | H26 | 60.0° | 59.6° |
| C26 | N25 | C24 | C23 | 83.3° | 75.9° |
| C26 | N25 | C24 | H6 | 156.3° | 44.1° |
| C26 | N25 | C24 | H7 | 37.2° | 164.1° |
| C26 | N25 | C27 | H9 | 180.0° | 56.0° |
| C26 | N25 | C27 | H10 | 60.0° | 176.1° |
| C26 | N25 | C27 | H11 | 60.0° | 63.9° |
| N25 | C26 | H24 | H25 | 120.0° | 120.0° |
| N25 | C26 | H24 | H26 | 120.0° | 120.1° |
| N25 | C26 | H25 | H26 | 120.0° | 120.1° |
| N25 | C24 | C23 | H6 | 120.4° | 120.0° |
| N25 | C24 | C23 | H7 | 120.4° | 120.0° |
| N25 | C24 | C23 | C28 | 80.7° | 64.3° |
| N25 | C24 | C23 | N22 | 162.6° | 175.6° |
| N25 | C24 | H6 | H7 | 118.7° | 120.0° |
| C24 | N25 | C27 | H9 | 57.0° | 180.0° |
| C24 | N25 | C27 | H10 | 177.0° | 60.0° |
| C24 | N25 | C27 | H11 | 63.0° | 60.0° |
| N25 | C24 | C23 | H23 | 43.0° | 55.6° |
| C24 | N25 | C26 | H24 | 61.6° | 55.7° |
| C24 | N25 | C26 | H25 | 58.4° | 175.6° |
| C24 | N25 | C26 | H26 | 178.4° | 64.4° |
| C24 | C23 | C28 | C29 | 121.1° | 100.0° |
| C24 | C23 | C28 | N22 | 117.8° | 120.0° |
| C24 | C23 | C28 | H23 | 122.7° | 119.9° |
| C24 | C23 | N22 | H23 | 119.0° | 120.0° |
| C24 | C23 | C28 | C33 | 57.7° | 80.6° |
| C24 | C23 | N22 | C20 | 114.3° | 81.2° |
| C23 | C24 | H6 | H7 | 118.7° | 120.0° |
| C24 | C23 | N22 | H27 | 65.7° | 98.9° |
| C30 | C29 | C28 | H22 | 180.0° | 179.4° |
| C30 | C29 | C28 | C23 | 179.5° | 180.0° |
| C29 | C30 | C31 | H12 | 180.0° | 179.7° |
| C30 | C29 | C28 | C33 | 0.6° | 0.6° |
| C29 | C30 | C31 | C32 | 0.2° | 0.4° |
| C29 | C30 | C31 | H13 | 179.8° | 179.8° |
| C29 | C28 | C23 | C33 | 178.9° | 179.4° |
| C29 | C28 | C23 | N22 | 121.0° | 140.0° |
| C28 | C29 | C30 | C31 | 0.2° | 0.6° |
| C29 | C28 | C33 | C32 | 0.7° | 0.4° |
| C28 | C29 | C30 | H12 | 179.9° | 179.7° |
| C29 | C28 | C33 | H15 | 179.3° | 179.7° |
| C29 | C28 | C23 | H23 | 1.6° | 20.0° |
| O21 | C20 | N22 | C23 | 1.8° | 4.8° |
| O21 | C20 | N22 | N18 | 178.9° | 179.9° |
| O21 | C20 | N18 | C19 | 1.5° | 0.1° |
| O21 | C20 | N18 | C17 | 176.7° | 180.0° |
| O21 | C20 | N22 | H27 | 178.2° | 175.1° |
| C28 | C23 | N22 | H23 | 120.1° | 120.0° |
| C28 | C23 | N22 | C20 | 124.9° | 158.8° |
| C23 | C28 | C33 | C32 | 179.5° | 179.8° |
| C28 | C23 | C24 | H6 | 158.8° | 175.7° |
| C28 | C23 | C24 | H7 | 39.7° | 55.7° |
| C23 | C28 | C33 | H15 | 0.5° | 0.3° |
| C23 | C28 | C29 | H22 | 0.5° | 0.6° |
| C28 | C23 | N22 | H27 | 55.1° | 21.1° |
| N22 | C23 | C28 | C33 | 60.1° | 39.4° |
| C23 | N22 | C20 | H27 | 180.0° | 179.9° |
| C23 | N22 | C20 | N18 | 179.3° | 175.1° |
| N22 | C23 | C24 | H6 | 42.1° | 55.6° |
| N22 | C23 | C24 | H7 | 77.0° | 64.3° |
| C30 | C31 | C32 | H13 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.1° | 0.1° |
| C30 | C31 | C32 | H14 | 179.9° | 180.0° |
| C31 | C30 | C29 | H22 | 179.8° | 180.0° |
| C28 | C33 | C32 | C31 | 0.3° | 0.1° |
| C28 | C33 | C32 | H15 | 180.0° | 179.9° |
| C28 | C33 | C32 | H14 | 179.7° | 180.0° |
| C33 | C28 | C29 | H22 | 179.4° | 180.0° |
| C33 | C28 | C23 | H23 | 179.5° | 159.5° |
| N22 | C20 | N18 | C19 | 179.6° | 180.0° |
| N22 | C20 | N18 | C17 | 2.1° | 0.1° |
| C20 | N22 | C23 | H23 | 4.7° | 38.8° |
| C20 | N18 | C19 | C34 | 63.1° | 60.6° |
| C20 | N18 | C19 | C35 | 59.5° | 60.4° |
| C20 | N18 | C19 | C17 | 178.6° | 179.9° |
| C20 | N18 | C19 | C14 | 177.3° | 179.9° |
| C20 | N18 | C17 | C13 | 177.4° | 179.9° |
| N18 | C20 | N22 | H27 | 0.7° | 5.0° |
| C20 | N18 | C17 | H28 | 62.1° | 60.5° |
| C20 | N18 | C17 | H29 | 56.9° | 60.6° |
| C34 | C19 | C35 | N18 | 125.4° | 120.9° |
| C34 | C19 | C35 | C14 | 121.2° | 121.0° |
| C34 | C19 | N18 | C14 | 119.6° | 119.5° |
| C34 | C19 | N18 | C17 | 118.4° | 119.5° |
| C34 | C19 | C14 | C13 | 120.7° | 119.5° |
| C34 | C19 | C14 | N15 | 57.8° | 60.4° |
| C19 | C34 | H16 | H17 | 120.0° | 120.0° |
| C19 | C34 | H16 | H18 | 120.0° | 120.1° |
| C19 | C34 | H17 | H18 | 120.0° | 120.0° |
| C34 | C19 | C35 | H19 | 180.0° | 60.9° |
| C34 | C19 | C35 | H20 | 60.0° | 59.0° |
| C34 | C19 | C35 | H21 | 60.0° | 179.0° |
| C31 | C32 | C33 | H14 | 180.0° | 179.9° |
| C32 | C31 | C30 | H12 | 179.8° | 180.0° |
| C31 | C32 | C33 | H15 | 179.7° | 180.0° |
| C33 | C32 | C31 | H13 | 179.9° | 180.0° |
| C35 | C19 | N18 | C14 | 117.8° | 119.5° |
| C35 | C19 | N18 | C17 | 119.1° | 119.5° |
| C35 | C19 | C14 | C13 | 119.1° | 119.5° |
| C35 | C19 | C14 | N15 | 62.3° | 60.6° |
| C35 | C19 | C34 | H16 | 180.0° | 179.0° |
| C35 | C19 | C34 | H17 | 60.0° | 59.1° |
| C35 | C19 | C34 | H18 | 60.0° | 60.9° |
| C19 | C35 | H19 | H20 | 120.0° | 119.9° |
| C19 | C35 | H19 | H21 | 120.0° | 120.0° |
| C19 | C35 | H20 | H21 | 120.0° | 120.0° |
| C19 | N18 | C17 | C13 | 1.1° | 0.0° |
| N18 | C19 | C14 | C13 | 1.0° | 0.0° |
| N18 | C19 | C14 | N15 | 179.5° | 179.9° |
| N18 | C19 | C34 | H16 | 56.3° | 60.0° |
| N18 | C19 | C34 | H17 | 176.3° | 180.0° |
| N18 | C19 | C34 | H18 | 63.7° | 60.0° |
| N18 | C19 | C35 | H19 | 54.6° | 60.0° |
| N18 | C19 | C35 | H20 | 65.4° | 179.9° |
| N18 | C19 | C35 | H21 | 174.6° | 60.0° |
| C19 | N18 | C17 | H28 | 119.3° | 119.4° |
| C19 | N18 | C17 | H29 | 121.6° | 119.5° |
| C17 | N18 | C19 | C14 | 1.2° | 0.0° |
| N18 | C17 | C13 | H28 | 120.4° | 119.5° |
| N18 | C17 | C13 | H29 | 120.5° | 119.5° |
| N18 | C17 | C13 | C14 | 0.5° | 0.0° |
| N18 | C17 | C13 | C12 | 176.8° | 179.9° |
| N18 | C17 | H28 | H29 | 118.6° | 121.0° |
| C19 | C14 | C13 | C17 | 0.4° | 0.0° |
| C19 | C14 | C13 | N15 | 179.1° | 179.9° |
| C19 | C14 | C13 | C12 | 178.7° | 180.0° |
| C19 | C14 | N15 | N16 | 179.9° | 179.9° |
| C14 | C19 | C34 | H16 | 58.9° | 58.0° |
| C14 | C19 | C34 | H17 | 61.1° | 61.9° |
| C14 | C19 | C34 | H18 | 178.9° | 178.1° |
| C14 | C19 | C35 | H19 | 58.7° | 178.1° |
| C14 | C19 | C35 | H20 | 178.8° | 62.0° |
| C14 | C19 | C35 | H21 | 61.3° | 58.0° |
| C19 | C14 | N15 | H30 | 0.1° | 0.1° |
| C17 | C13 | C14 | C12 | 178.3° | 180.0° |
| C17 | C13 | C14 | N15 | 179.5° | 179.9° |
| C17 | C13 | C12 | N16 | 179.4° | 179.9° |
| C17 | C13 | C12 | N10 | 2.6° | 0.2° |
| C13 | C17 | H28 | H29 | 118.6° | 121.0° |
| C13 | C14 | N15 | N16 | 1.5° | 0.0° |
| C14 | C13 | C12 | N16 | 2.1° | 0.0° |
| C14 | C13 | C12 | N10 | 179.9° | 179.8° |
| C14 | C13 | C17 | H28 | 120.0° | 119.5° |
| C14 | C13 | C17 | H29 | 121.0° | 119.5° |
| C13 | C14 | N15 | H30 | 178.5° | 180.0° |
| N15 | C14 | C13 | C12 | 2.2° | 0.0° |
| C14 | N15 | N16 | H30 | 180.0° | 179.9° |
| C14 | N15 | N16 | C12 | 0.2° | 0.0° |
| C13 | C12 | N16 | N15 | 1.2° | 0.0° |
| C13 | C12 | N16 | N10 | 178.5° | 179.8° |
| C13 | C12 | N10 | C6 | 32.3° | 179.7° |
| C12 | C13 | C17 | H28 | 62.8° | 60.6° |
| C12 | C13 | C17 | H29 | 56.3° | 60.5° |
| C13 | C12 | N10 | H31 | 147.7° | 0.2° |
| N15 | N16 | C12 | N10 | 179.7° | 179.8° |
| N16 | C12 | N10 | C6 | 149.9° | 0.0° |
| C12 | N16 | N15 | H30 | 179.8° | 179.9° |
| N16 | C12 | N10 | H31 | 30.1° | 179.9° |
| C12 | N10 | C6 | N5 | 0.5° | 0.1° |
| C12 | N10 | C6 | H31 | 180.0° | 179.9° |
| C12 | N10 | C6 | C1 | 178.8° | 180.0° |
| C11 | C4 | N5 | N3 | 179.1° | 179.6° |
| C11 | C4 | N5 | C6 | 179.4° | 179.7° |
| C11 | C4 | N3 | C2 | 179.8° | 180.0° |
| C4 | C11 | H3 | H4 | 120.0° | 120.0° |
| C4 | C11 | H3 | H5 | 120.0° | 119.9° |
| C4 | C11 | H4 | H5 | 120.0° | 120.0° |
| C4 | N5 | C6 | N10 | 178.1° | 179.6° |
| C4 | N5 | C6 | C1 | 1.2° | 0.5° |
| N5 | C4 | N3 | C2 | 1.1° | 0.4° |
| N5 | C4 | C11 | H3 | 0.0° | 89.6° |
| N5 | C4 | C11 | H4 | 120.0° | 30.4° |
| N5 | C4 | C11 | H5 | 120.0° | 150.5° |
| C6 | N5 | C4 | N3 | 1.5° | 0.7° |
| N5 | C6 | N10 | C1 | 179.3° | 179.9° |
| N5 | C6 | C1 | C2 | 0.4° | 0.1° |
| N5 | C6 | C1 | S7 | 179.0° | 179.7° |
| N5 | C6 | N10 | H31 | 179.5° | 179.9° |
| C4 | N3 | C2 | C1 | 0.4° | 0.0° |
| C4 | N3 | C2 | C9 | 179.5° | 180.0° |
| N3 | C4 | C11 | H3 | 179.1° | 90.0° |
| N3 | C4 | C11 | H4 | 59.1° | 150.0° |
| N3 | C4 | C11 | H5 | 60.9° | 29.9° |
| N10 | C6 | C1 | C2 | 178.9° | 180.0° |
| N10 | C6 | C1 | S7 | 1.6° | 0.2° |
| C6 | C1 | C2 | N3 | 0.1° | 0.2° |
| C6 | C1 | C2 | S7 | 179.6° | 179.8° |
| C6 | C1 | C2 | C9 | 179.8° | 179.8° |
| C6 | C1 | S7 | C8 | 179.7° | 179.8° |
| C1 | C6 | N10 | H31 | 1.2° | 0.2° |
| N3 | C2 | C1 | C9 | 179.9° | 180.0° |
| N3 | C2 | C1 | S7 | 179.5° | 180.0° |
| N3 | C2 | C9 | C8 | 180.0° | 180.0° |
| N3 | C2 | C9 | H2 | 0.1° | 0.0° |
| C2 | C1 | S7 | C8 | 0.7° | 0.0° |
| C1 | C2 | C9 | C8 | 0.0° | 0.0° |
| C1 | C2 | C9 | H2 | 180.0° | 180.0° |
| S7 | C1 | C2 | C9 | 0.5° | 0.0° |
| C1 | S7 | C8 | C9 | 0.7° | 0.0° |
| C1 | S7 | C8 | H1 | 179.3° | 180.0° |
| C2 | C9 | C8 | S7 | 0.5° | 0.0° |
| C2 | C9 | C8 | H2 | 180.0° | 180.0° |
| C2 | C9 | C8 | H1 | 179.5° | 180.0° |
| S7 | C8 | C9 | H1 | 180.0° | 180.0° |
| S7 | C8 | C9 | H2 | 179.5° | 180.0° |
| H1 | C8 | C9 | H2 | 0.5° | 0.0° |
| H3 | C11 | H4 | H5 | 120.0° | 120.0° |
| H6 | C24 | C23 | H23 | 77.4° | 64.4° |
| H7 | C24 | C23 | H23 | 163.4° | 175.7° |
| H9 | C27 | H10 | H11 | 120.0° | 120.0° |
| H12 | C30 | C31 | H13 | 0.2° | 0.1° |
| H12 | C30 | C29 | H22 | 0.1° | 0.4° |
| H13 | C31 | C32 | H14 | 0.1° | 0.1° |
| H14 | C32 | C33 | H15 | 0.3° | 0.1° |
| H16 | C34 | H17 | H18 | 120.0° | 120.0° |
| H19 | C35 | H20 | H21 | 120.0° | 120.1° |
| H23 | C23 | N22 | H27 | 175.3° | 141.1° |
| H24 | C26 | H25 | H26 | 120.0° | 120.0° |
