BI6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C49 | C9 | sing | 1.61Å | 1.61Å | |
| C49 | C8 | sing | 1.47Å | 1.47Å | |
| C9 | C10 | sing | 1.63Å | 1.63Å | |
| C10 | N3 | sing | 1.56Å | 1.56Å | |
| C10 | C11 | sing | 1.47Å | 1.47Å | |
| N3 | C6 | sing | 1.43Å | 1.43Å | |
| N3 | C13 | sing | 1.49Å | 1.49Å | |
| C6 | C5 | sing | 1.58Å | 1.58Å | |
| C6 | O2 | doub | 1.27Å | 1.27Å | |
| C5 | N2 | sing | 1.43Å | 1.43Å | |
| C5 | C7 | sing | 1.44Å | 1.44Å | |
| N2 | C4 | sing | 1.38Å | 1.38Å | |
| C4 | C1 | sing | 1.50Å | 1.50Å | |
| C4 | O1 | doub | 1.26Å | 1.26Å | |
| C1 | C2 | sing | 1.57Å | 1.57Å | |
| C1 | N1 | sing | 1.47Å | 1.47Å | |
| C2 | C3 | sing | 1.55Å | 1.55Å | |
| N1 | C26 | doub | 1.40Å | 1.40Å | |
| C7 | C8 | doub | 1.25Å | 1.25Å | |
| C13 | C14 | sing | 1.54Å | 1.54Å | |
| C13 | C12 | sing | 1.47Å | 1.47Å | |
| C14 | O3 | doub | 1.23Å | 1.23Å | |
| C14 | N4 | sing | 1.42Å | 1.42Å | |
| N4 | C15 | sing | 1.51Å | 1.51Å | |
| C15 | C17 | sing | 1.62Å | 1.62Å | |
| C15 | C16 | sing | 1.56Å | 1.56Å | |
| C17 | C18 | sing | 1.49Å | 1.49Å | Aromatic |
| C17 | C22 | doub | 1.47Å | 1.47Å | Aromatic |
| C18 | C19 | doub | 1.45Å | 1.45Å | Aromatic |
| C19 | C20 | sing | 1.44Å | 1.44Å | Aromatic |
| C20 | C21 | doub | 1.46Å | 1.46Å | Aromatic |
| C21 | C22 | sing | 1.46Å | 1.46Å | Aromatic |
| C16 | C23 | sing | 1.48Å | 1.48Å | Aromatic |
| C16 | C27 | doub | 1.43Å | 1.43Å | Aromatic |
| C23 | C24 | doub | 1.42Å | 1.42Å | Aromatic |
| C24 | C25 | sing | 1.43Å | 1.43Å | Aromatic |
| C25 | C28 | doub | 1.45Å | 1.45Å | Aromatic |
| C27 | C28 | sing | 1.43Å | 1.43Å | Aromatic |
| C12 | C11 | sing | 1.64Å | 1.64Å | |
| C49 | H491 | sing | 1.10Å | 1.10Å | |
| C49 | H492 | sing | 1.10Å | 1.10Å | |
| C9 | H91C | sing | 1.10Å | 1.10Å | |
| C9 | H92C | sing | 1.10Å | 1.10Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.10Å | 1.10Å | |
| C11 | H111 | sing | 1.10Å | 1.10Å | |
| C11 | H112 | sing | 1.10Å | 1.10Å | |
| C13 | H13 | sing | 1.10Å | 1.10Å | |
| C5 | H5 | sing | 1.10Å | 1.10Å | |
| N2 | H2 | sing | 1.00Å | 1.00Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.10Å | 1.10Å | |
| C2 | H21C | sing | 1.10Å | 1.10Å | |
| C2 | H22C | sing | 1.10Å | 1.10Å | |
| C3 | H31C | sing | 1.10Å | 1.10Å | |
| C3 | H32C | sing | 1.10Å | 1.10Å | |
| C3 | H33C | sing | 1.10Å | 1.10Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C26 | H262 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.10Å | 1.10Å | |
| C12 | H122 | sing | 1.10Å | 1.10Å | |
| N4 | H4 | sing | 1.00Å | 1.00Å | |
| C15 | H15 | sing | 1.10Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C9 | C49 | C8 | 120.6° | 120.6° |
| C49 | C9 | C10 | 122.8° | 122.8° |
| C9 | C49 | H491 | 105.9° | 105.9° |
| C9 | C49 | H492 | 103.3° | 103.3° |
| C49 | C9 | H91C | 105.2° | 105.2° |
| C49 | C9 | H92C | 102.1° | 102.1° |
| C49 | C8 | C7 | 131.5° | 131.5° |
| C8 | C49 | H491 | 105.9° | 105.9° |
| C8 | C49 | H492 | 103.4° | 103.4° |
| C49 | C8 | H8 | 114.3° | 114.3° |
| C9 | C10 | N3 | 122.0° | 122.0° |
| C9 | C10 | C11 | 119.3° | 119.3° |
| C10 | C9 | H91C | 105.3° | 105.3° |
| C10 | C9 | H92C | 102.1° | 102.1° |
| C9 | C10 | H10 | 88.7° | 88.6° |
| N3 | C10 | C11 | 94.7° | 94.7° |
| C10 | N3 | C6 | 127.2° | 127.2° |
| C10 | N3 | C13 | 116.6° | 116.6° |
| N3 | C10 | H10 | 115.8° | 115.8° |
| C10 | C11 | C12 | 105.9° | 105.9° |
| C11 | C10 | H10 | 118.7° | 118.7° |
| C10 | C11 | H111 | 110.7° | 110.7° |
| C10 | C11 | H112 | 111.5° | 111.5° |
| C6 | N3 | C13 | 116.2° | 116.2° |
| N3 | C6 | C5 | 127.8° | 127.8° |
| N3 | C6 | O2 | 119.6° | 119.6° |
| N3 | C13 | C14 | 112.9° | 112.9° |
| N3 | C13 | C12 | 93.6° | 93.6° |
| N3 | C13 | H13 | 126.7° | 126.7° |
| C5 | C6 | O2 | 112.6° | 112.6° |
| C6 | C5 | N2 | 120.8° | 120.8° |
| C6 | C5 | C7 | 112.7° | 112.7° |
| C6 | C5 | H5 | 97.8° | 97.8° |
| N2 | C5 | C7 | 108.5° | 108.5° |
| C5 | N2 | C4 | 114.3° | 114.3° |
| N2 | C5 | H5 | 103.1° | 103.1° |
| C5 | N2 | H2 | 122.9° | 122.9° |
| C5 | C7 | C8 | 131.5° | 131.5° |
| C7 | C5 | H5 | 113.2° | 113.2° |
| C5 | C7 | H7 | 114.3° | 114.3° |
| N2 | C4 | C1 | 118.7° | 118.7° |
| N2 | C4 | O1 | 123.9° | 123.9° |
| C4 | N2 | H2 | 122.8° | 122.8° |
| C1 | C4 | O1 | 117.4° | 117.4° |
| C4 | C1 | C2 | 109.2° | 109.2° |
| C4 | C1 | N1 | 106.4° | 106.4° |
| C4 | C1 | H1 | 112.9° | 112.9° |
| C2 | C1 | N1 | 113.0° | 113.0° |
| C1 | C2 | C3 | 113.5° | 113.5° |
| C2 | C1 | H1 | 106.3° | 106.3° |
| C1 | C2 | H21C | 108.2° | 108.2° |
| C1 | C2 | H22C | 107.2° | 107.2° |
| C1 | N1 | C26 | 134.2° | 134.2° |
| N1 | C1 | H1 | 109.1° | 109.1° |
| C3 | C2 | H21C | 108.1° | 108.1° |
| C3 | C2 | H22C | 107.2° | 107.2° |
| C2 | C3 | H31C | 109.5° | 109.5° |
| C2 | C3 | H32C | 109.4° | 109.4° |
| C2 | C3 | H33C | 109.5° | 109.5° |
| N1 | C26 | H261 | 111.3° | 111.3° |
| N1 | C26 | H262 | 124.4° | 124.4° |
| C7 | C8 | H8 | 114.3° | 114.3° |
| C8 | C7 | H7 | 114.3° | 114.3° |
| C14 | C13 | C12 | 128.8° | 128.8° |
| C13 | C14 | O3 | 117.7° | 117.7° |
| C13 | C14 | N4 | 94.0° | 94.0° |
| C14 | C13 | H13 | 88.9° | 88.9° |
| C13 | C12 | C11 | 98.9° | 98.9° |
| C12 | C13 | H13 | 109.8° | 109.8° |
| C13 | C12 | H121 | 113.2° | 113.2° |
| C13 | C12 | H122 | 115.3° | 115.3° |
| O3 | C14 | N4 | 124.8° | 124.8° |
| C14 | N4 | C15 | 114.5° | 114.5° |
| C14 | N4 | H4 | 122.8° | 122.8° |
| N4 | C15 | C17 | 115.3° | 115.3° |
| N4 | C15 | C16 | 108.4° | 108.4° |
| C15 | N4 | H4 | 122.7° | 122.7° |
| N4 | C15 | H15 | 105.9° | 105.9° |
| C17 | C15 | C16 | 108.4° | 108.4° |
| C15 | C17 | C18 | 119.7° | 119.7° |
| C15 | C17 | C22 | 122.0° | 122.0° |
| C17 | C15 | H15 | 105.8° | 105.8° |
| C15 | C16 | C23 | 126.8° | 126.8° |
| C15 | C16 | C27 | 115.1° | 115.1° |
| C16 | C15 | H15 | 113.1° | 113.1° |
| C18 | C17 | C22 | 118.2° | 118.2° |
| C17 | C18 | C19 | 119.9° | 119.9° |
| C17 | C18 | H18 | 120.1° | 120.1° |
| C17 | C22 | C21 | 120.6° | 120.6° |
| C17 | C22 | H22 | 119.7° | 119.7° |
| C18 | C19 | C20 | 121.1° | 121.1° |
| C19 | C18 | H18 | 120.0° | 120.0° |
| C18 | C19 | H19 | 119.5° | 119.5° |
| C19 | C20 | C21 | 120.0° | 120.0° |
| C20 | C19 | H19 | 119.4° | 119.4° |
| C19 | C20 | H20 | 120.0° | 120.0° |
| C20 | C21 | C22 | 120.2° | 120.2° |
| C21 | C20 | H20 | 120.0° | 120.0° |
| C20 | C21 | H21 | 119.9° | 119.9° |
| C21 | C22 | H22 | 119.7° | 119.7° |
| C22 | C21 | H21 | 119.9° | 119.9° |
| C23 | C16 | C27 | 118.0° | 118.0° |
| C16 | C23 | C24 | 121.0° | 121.0° |
| C16 | C23 | H23 | 119.5° | 119.5° |
| C16 | C27 | C28 | 121.3° | 121.3° |
| C16 | C27 | H27 | 119.3° | 119.4° |
| C23 | C24 | C25 | 119.4° | 119.4° |
| C24 | C23 | H23 | 119.5° | 119.5° |
| C23 | C24 | H24 | 120.3° | 120.3° |
| C24 | C25 | C28 | 120.7° | 120.7° |
| C25 | C24 | H24 | 120.3° | 120.3° |
| C24 | C25 | H25 | 119.7° | 119.7° |
| C25 | C28 | C27 | 119.5° | 119.5° |
| C28 | C25 | H25 | 119.7° | 119.7° |
| C25 | C28 | H28 | 120.2° | 120.2° |
| C28 | C27 | H27 | 119.4° | 119.3° |
| C27 | C28 | H28 | 120.2° | 120.2° |
| C12 | C11 | H111 | 110.7° | 110.7° |
| C12 | C11 | H112 | 111.4° | 111.4° |
| C11 | C12 | H121 | 113.2° | 113.2° |
| C11 | C12 | H122 | 115.4° | 115.4° |
| H491 | C49 | H492 | 118.6° | 118.6° |
| H91C | C9 | H92C | 120.7° | 120.7° |
| H111 | C11 | H112 | 106.8° | 106.8° |
| H21C | C2 | H22C | 112.7° | 112.7° |
| H31C | C3 | H32C | 109.5° | 109.4° |
| H31C | C3 | H33C | 109.4° | 109.5° |
| H32C | C3 | H33C | 109.5° | 109.5° |
| H261 | C26 | H262 | 124.3° | 124.3° |
| H121 | C12 | H122 | 101.6° | 101.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C9 | C49 | C8 | H491 | 120.0° | 120.0° |
| C9 | C49 | C8 | H492 | 114.5° | 114.5° |
| C49 | C9 | C10 | H91C | 120.0° | 120.0° |
| C49 | C9 | C10 | H92C | 113.2° | 113.2° |
| C49 | C9 | C10 | N3 | 0.4° | 0.4° |
| C49 | C9 | C10 | C11 | 117.2° | 117.2° |
| C9 | C49 | C8 | C7 | 26.7° | 26.7° |
| C9 | C49 | H491 | H492 | 115.4° | 115.4° |
| C49 | C9 | H91C | H92C | 114.5° | 114.5° |
| C9 | C49 | C8 | H8 | 153.3° | 153.3° |
| C49 | C9 | C10 | H10 | 120.3° | 120.3° |
| C8 | C49 | C9 | C10 | 43.8° | 43.8° |
| C49 | C8 | C7 | C5 | 79.5° | 79.5° |
| C49 | C8 | C7 | H8 | 180.0° | 180.0° |
| C8 | C49 | H491 | H492 | 115.5° | 115.5° |
| C8 | C49 | C9 | H91C | 76.2° | 76.2° |
| C8 | C49 | C9 | H92C | 156.9° | 156.9° |
| C49 | C8 | C7 | H7 | 100.4° | 100.4° |
| C9 | C10 | N3 | C11 | 129.2° | 129.2° |
| C9 | C10 | N3 | H10 | 105.7° | 105.8° |
| C9 | C10 | C11 | H10 | 106.1° | 106.1° |
| C9 | C10 | N3 | C6 | 58.0° | 58.0° |
| C9 | C10 | N3 | C13 | 121.4° | 121.4° |
| C9 | C10 | C11 | C12 | 156.2° | 156.2° |
| C10 | C9 | C49 | H491 | 76.2° | 76.2° |
| C10 | C9 | C49 | H492 | 158.3° | 158.3° |
| C10 | C9 | H91C | H92C | 114.5° | 114.5° |
| C9 | C10 | C11 | H111 | 83.8° | 83.8° |
| C9 | C10 | C11 | H112 | 34.8° | 34.8° |
| N3 | C10 | C11 | H10 | 122.8° | 122.9° |
| C10 | N3 | C6 | C13 | 179.4° | 179.4° |
| C10 | N3 | C6 | C5 | 0.3° | 0.3° |
| C10 | N3 | C6 | O2 | 179.9° | 179.9° |
| C10 | N3 | C13 | C14 | 95.4° | 95.4° |
| C10 | N3 | C13 | C12 | 39.7° | 39.7° |
| N3 | C10 | C11 | C12 | 25.1° | 25.1° |
| N3 | C10 | C9 | H91C | 119.6° | 119.6° |
| N3 | C10 | C9 | H92C | 113.6° | 113.6° |
| N3 | C10 | C11 | H111 | 145.1° | 145.1° |
| N3 | C10 | C11 | H112 | 96.2° | 96.2° |
| C10 | N3 | C13 | H13 | 157.8° | 157.8° |
| C11 | C10 | N3 | C6 | 172.8° | 172.8° |
| C11 | C10 | N3 | C13 | 7.8° | 7.8° |
| C10 | C11 | C12 | C13 | 52.6° | 52.6° |
| C10 | C11 | C12 | H111 | 120.0° | 120.0° |
| C10 | C11 | C12 | H112 | 121.4° | 121.4° |
| C11 | C10 | C9 | H91C | 122.9° | 122.9° |
| C11 | C10 | C9 | H92C | 4.0° | 4.0° |
| C10 | C11 | H111 | H112 | 121.5° | 121.5° |
| C10 | C11 | C12 | H121 | 172.6° | 172.6° |
| C10 | C11 | C12 | H122 | 71.0° | 71.0° |
| N3 | C6 | C5 | O2 | 179.7° | 179.7° |
| N3 | C6 | C5 | N2 | 165.1° | 165.1° |
| N3 | C6 | C5 | C7 | 64.3° | 64.3° |
| C6 | N3 | C13 | C14 | 84.0° | 84.0° |
| C6 | N3 | C13 | C12 | 140.8° | 140.8° |
| C6 | N3 | C10 | H10 | 47.7° | 47.8° |
| C6 | N3 | C13 | H13 | 22.8° | 22.8° |
| N3 | C6 | C5 | H5 | 54.8° | 54.8° |
| C13 | N3 | C6 | C5 | 179.1° | 179.1° |
| C13 | N3 | C6 | O2 | 0.5° | 0.5° |
| N3 | C13 | C14 | C12 | 115.4° | 115.4° |
| N3 | C13 | C14 | H13 | 129.8° | 129.8° |
| N3 | C13 | C12 | H13 | 131.2° | 131.2° |
| N3 | C13 | C14 | O3 | 1.0° | 1.0° |
| N3 | C13 | C14 | N4 | 134.1° | 134.1° |
| N3 | C13 | C12 | C11 | 49.2° | 49.2° |
| C13 | N3 | C10 | H10 | 132.9° | 132.9° |
| N3 | C13 | C12 | H121 | 169.2° | 169.2° |
| N3 | C13 | C12 | H122 | 74.4° | 74.4° |
| C6 | C5 | N2 | C7 | 132.3° | 132.3° |
| C6 | C5 | N2 | H5 | 107.5° | 107.5° |
| C6 | C5 | C7 | H5 | 109.8° | 109.8° |
| C6 | C5 | N2 | C4 | 139.1° | 139.1° |
| C6 | C5 | C7 | C8 | 2.4° | 2.4° |
| C6 | C5 | N2 | H2 | 40.9° | 40.9° |
| C6 | C5 | C7 | H7 | 177.6° | 177.6° |
| O2 | C6 | C5 | N2 | 15.2° | 15.2° |
| O2 | C6 | C5 | C7 | 115.3° | 115.3° |
| O2 | C6 | C5 | H5 | 125.5° | 125.5° |
| N2 | C5 | C7 | H5 | 113.7° | 113.7° |
| C5 | N2 | C4 | H2 | 180.0° | 180.0° |
| C5 | N2 | C4 | C1 | 179.1° | 179.1° |
| C5 | N2 | C4 | O1 | 0.5° | 0.5° |
| N2 | C5 | C7 | C8 | 138.9° | 138.9° |
| N2 | C5 | C7 | H7 | 41.1° | 41.1° |
| C7 | C5 | N2 | C4 | 88.6° | 88.6° |
| C5 | C7 | C8 | H7 | 180.0° | 180.0° |
| C5 | C7 | C8 | H8 | 100.4° | 100.4° |
| C7 | C5 | N2 | H2 | 91.4° | 91.4° |
| N2 | C4 | C1 | O1 | 179.6° | 179.6° |
| N2 | C4 | C1 | C2 | 108.3° | 108.3° |
| N2 | C4 | C1 | N1 | 129.4° | 129.4° |
| C4 | N2 | C5 | H5 | 31.6° | 31.6° |
| N2 | C4 | C1 | H1 | 9.7° | 9.7° |
| C4 | C1 | C2 | N1 | 118.2° | 118.2° |
| C4 | C1 | C2 | H1 | 122.1° | 122.1° |
| C4 | C1 | N1 | H1 | 122.1° | 122.1° |
| C4 | C1 | C2 | C3 | 62.8° | 62.8° |
| C4 | C1 | N1 | C26 | 75.6° | 75.6° |
| C1 | C4 | N2 | H2 | 0.9° | 0.9° |
| C4 | C1 | C2 | H21C | 177.2° | 177.2° |
| C4 | C1 | C2 | H22C | 55.4° | 55.4° |
| O1 | C4 | C1 | C2 | 71.3° | 71.3° |
| O1 | C4 | C1 | N1 | 51.0° | 51.0° |
| O1 | C4 | N2 | H2 | 179.5° | 179.5° |
| O1 | C4 | C1 | H1 | 170.6° | 170.6° |
| C2 | C1 | N1 | H1 | 118.0° | 118.0° |
| C1 | C2 | C3 | H21C | 120.0° | 120.0° |
| C1 | C2 | C3 | H22C | 118.2° | 118.2° |
| C2 | C1 | N1 | C26 | 164.5° | 164.5° |
| C1 | C2 | H21C | H22C | 118.3° | 118.3° |
| C1 | C2 | C3 | H31C | 104.4° | 104.4° |
| C1 | C2 | C3 | H32C | 15.6° | 15.6° |
| C1 | C2 | C3 | H33C | 135.6° | 135.6° |
| N1 | C1 | C2 | C3 | 178.9° | 178.9° |
| N1 | C1 | C2 | H21C | 58.9° | 58.9° |
| N1 | C1 | C2 | H22C | 62.8° | 62.8° |
| C1 | N1 | C26 | H261 | 180.0° | 180.0° |
| C1 | N1 | C26 | H262 | 0.0° | 0.0° |
| C3 | C2 | C1 | H1 | 59.3° | 59.3° |
| C3 | C2 | H21C | H22C | 118.3° | 118.3° |
| C2 | C3 | H31C | H32C | 120.0° | 120.0° |
| C2 | C3 | H31C | H33C | 120.0° | 120.0° |
| C2 | C3 | H32C | H33C | 120.0° | 120.0° |
| C26 | N1 | C1 | H1 | 46.5° | 46.5° |
| N1 | C26 | H261 | H262 | 179.9° | 179.9° |
| C7 | C8 | C49 | H491 | 146.7° | 146.7° |
| C7 | C8 | C49 | H492 | 87.9° | 87.9° |
| C8 | C7 | C5 | H5 | 107.3° | 107.3° |
| C14 | C13 | C12 | H13 | 105.3° | 105.3° |
| C13 | C14 | O3 | N4 | 117.4° | 117.4° |
| C13 | C14 | N4 | C15 | 177.6° | 177.6° |
| C14 | C13 | C12 | C11 | 74.3° | 74.3° |
| C14 | C13 | C12 | H121 | 45.7° | 45.7° |
| C14 | C13 | C12 | H122 | 162.1° | 162.1° |
| C13 | C14 | N4 | H4 | 2.4° | 2.4° |
| C12 | C13 | C14 | O3 | 116.4° | 116.4° |
| C12 | C13 | C14 | N4 | 110.6° | 110.6° |
| C13 | C12 | C11 | H121 | 120.0° | 120.0° |
| C13 | C12 | C11 | H122 | 123.6° | 123.6° |
| C13 | C12 | C11 | H111 | 172.6° | 172.6° |
| C13 | C12 | C11 | H112 | 68.8° | 68.8° |
| C13 | C12 | H121 | H122 | 124.3° | 124.3° |
| O3 | C14 | N4 | C15 | 54.4° | 54.4° |
| O3 | C14 | C13 | H13 | 128.8° | 128.8° |
| O3 | C14 | N4 | H4 | 125.6° | 125.6° |
| C14 | N4 | C15 | H4 | 180.0° | 180.0° |
| C14 | N4 | C15 | C17 | 59.6° | 59.6° |
| C14 | N4 | C15 | C16 | 178.7° | 178.7° |
| N4 | C14 | C13 | H13 | 4.2° | 4.2° |
| C14 | N4 | C15 | H15 | 57.0° | 57.0° |
| N4 | C15 | C17 | C16 | 121.7° | 121.7° |
| N4 | C15 | C17 | H15 | 116.7° | 116.7° |
| N4 | C15 | C16 | H15 | 117.1° | 117.1° |
| N4 | C15 | C17 | C18 | 153.5° | 153.5° |
| N4 | C15 | C17 | C22 | 26.8° | 26.8° |
| N4 | C15 | C16 | C23 | 124.7° | 124.7° |
| N4 | C15 | C16 | C27 | 55.7° | 55.7° |
| C17 | C15 | C16 | H15 | 117.1° | 117.1° |
| C15 | C17 | C18 | C22 | 179.7° | 179.7° |
| C15 | C17 | C18 | C19 | 179.8° | 179.8° |
| C15 | C17 | C22 | C21 | 179.9° | 179.9° |
| C17 | C15 | C16 | C23 | 1.2° | 1.2° |
| C17 | C15 | C16 | C27 | 178.4° | 178.4° |
| C17 | C15 | N4 | H4 | 120.4° | 120.4° |
| C15 | C17 | C18 | H18 | 0.2° | 0.2° |
| C15 | C17 | C22 | H22 | 0.1° | 0.1° |
| C16 | C15 | C17 | C18 | 84.8° | 84.8° |
| C16 | C15 | C17 | C22 | 94.9° | 94.9° |
| C15 | C16 | C23 | C27 | 179.6° | 179.6° |
| C15 | C16 | C23 | C24 | 179.6° | 179.6° |
| C15 | C16 | C27 | C28 | 179.5° | 179.5° |
| C16 | C15 | N4 | H4 | 1.3° | 1.3° |
| C15 | C16 | C23 | H23 | 0.4° | 0.4° |
| C15 | C16 | C27 | H27 | 0.5° | 0.5° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.0° | 0.0° |
| C18 | C17 | C22 | C21 | 0.2° | 0.2° |
| C18 | C17 | C15 | H15 | 36.9° | 36.9° |
| C18 | C17 | C22 | H22 | 179.8° | 179.8° |
| C17 | C18 | C19 | H19 | 180.0° | 180.0° |
| C22 | C17 | C18 | C19 | 0.1° | 0.1° |
| C17 | C22 | C21 | C20 | 0.1° | 0.1° |
| C17 | C22 | C21 | H22 | 180.0° | 180.0° |
| C22 | C17 | C15 | H15 | 143.4° | 143.4° |
| C22 | C17 | C18 | H18 | 179.9° | 179.9° |
| C17 | C22 | C21 | H21 | 179.9° | 179.9° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.1° | 0.1° |
| C18 | C19 | C20 | H20 | 179.9° | 179.9° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.0° | 0.0° |
| C20 | C19 | C18 | H18 | 180.0° | 180.0° |
| C19 | C20 | C21 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | H22 | 179.9° | 179.9° |
| C21 | C20 | C19 | H19 | 179.9° | 179.9° |
| C22 | C21 | C20 | H20 | 180.0° | 180.0° |
| C16 | C23 | C24 | H23 | 180.0° | 180.0° |
| C16 | C23 | C24 | C25 | 0.2° | 0.2° |
| C23 | C16 | C27 | C28 | 0.1° | 0.1° |
| C23 | C16 | C15 | H15 | 118.3° | 118.3° |
| C23 | C16 | C27 | H27 | 179.8° | 179.9° |
| C16 | C23 | C24 | H24 | 179.8° | 179.8° |
| C27 | C16 | C23 | C24 | 0.0° | 0.0° |
| C16 | C27 | C28 | C25 | 0.1° | 0.1° |
| C16 | C27 | C28 | H27 | 180.0° | 180.0° |
| C27 | C16 | C15 | H15 | 61.3° | 61.3° |
| C27 | C16 | C23 | H23 | 180.0° | 180.0° |
| C16 | C27 | C28 | H28 | 179.9° | 179.9° |
| C23 | C24 | C25 | H24 | 180.0° | 180.0° |
| C23 | C24 | C25 | C28 | 0.2° | 0.2° |
| C23 | C24 | C25 | H25 | 179.8° | 179.8° |
| C24 | C25 | C28 | H25 | 180.0° | 180.0° |
| C24 | C25 | C28 | C27 | 0.0° | 0.0° |
| C25 | C24 | C23 | H23 | 179.8° | 179.8° |
| C24 | C25 | C28 | H28 | 179.9° | 179.9° |
| C25 | C28 | C27 | H28 | 180.0° | 180.0° |
| C25 | C28 | C27 | H27 | 179.8° | 179.9° |
| C28 | C25 | C24 | H24 | 179.8° | 179.8° |
| C27 | C28 | C25 | H25 | 180.0° | 180.0° |
| C12 | C11 | C10 | H10 | 97.7° | 97.8° |
| C12 | C11 | H111 | H112 | 121.4° | 121.4° |
| C11 | C12 | C13 | H13 | 179.6° | 179.6° |
| C11 | C12 | H121 | H122 | 124.3° | 124.3° |
| H491 | C49 | C9 | H91C | 163.8° | 163.8° |
| H491 | C49 | C9 | H92C | 36.9° | 36.9° |
| H491 | C49 | C8 | H8 | 33.3° | 33.3° |
| H492 | C49 | C9 | H91C | 38.3° | 38.3° |
| H492 | C49 | C9 | H92C | 88.5° | 88.5° |
| H492 | C49 | C8 | H8 | 92.1° | 92.1° |
| H91C | C9 | C10 | H10 | 0.3° | 0.3° |
| H92C | C9 | C10 | H10 | 126.5° | 126.5° |
| H8 | C8 | C7 | H7 | 79.6° | 79.6° |
| H10 | C10 | C11 | H111 | 22.3° | 22.2° |
| H10 | C10 | C11 | H112 | 140.9° | 140.9° |
| H111 | C11 | C12 | H121 | 67.4° | 67.4° |
| H111 | C11 | C12 | H122 | 49.0° | 49.0° |
| H112 | C11 | C12 | H121 | 51.2° | 51.2° |
| H112 | C11 | C12 | H122 | 167.6° | 167.6° |
| H13 | C13 | C12 | H121 | 59.6° | 59.6° |
| H13 | C13 | C12 | H122 | 56.8° | 56.8° |
| H5 | C5 | N2 | H2 | 148.4° | 148.4° |
| H5 | C5 | C7 | H7 | 72.6° | 72.6° |
| H1 | C1 | C2 | H21C | 60.7° | 60.7° |
| H1 | C1 | C2 | H22C | 177.5° | 177.5° |
| H21C | C2 | C3 | H31C | 135.6° | 135.6° |
| H21C | C2 | C3 | H32C | 104.4° | 104.4° |
| H21C | C2 | C3 | H33C | 15.6° | 15.6° |
| H22C | C2 | C3 | H31C | 13.8° | 13.9° |
| H22C | C2 | C3 | H32C | 133.9° | 133.9° |
| H22C | C2 | C3 | H33C | 106.1° | 106.1° |
| H31C | C3 | H32C | H33C | 120.0° | 120.0° |
| H4 | N4 | C15 | H15 | 123.0° | 123.0° |
| H18 | C18 | C19 | H19 | 0.0° | 0.0° |
| H22 | C22 | C21 | H21 | 0.1° | 0.1° |
| H19 | C19 | C20 | H20 | 0.1° | 0.1° |
| H20 | C20 | C21 | H21 | 0.0° | 0.0° |
| H23 | C23 | C24 | H24 | 0.2° | 0.2° |
| H27 | C27 | C28 | H28 | 0.1° | 0.1° |
| H24 | C24 | C25 | H25 | 0.2° | 0.2° |
| H25 | C25 | C28 | H28 | 0.1° | 0.1° |
