SBX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.52Å | |
| C1 | O1 | doub | 1.21Å | 1.33Å | |
| C1 | O2 | sing | 1.34Å | 1.22Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | N7 | sing | 1.47Å | 1.47Å | |
| C2 | H2 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | N7 | sing | 1.47Å | 1.47Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| N7 | C8 | sing | 1.35Å | 1.35Å | |
| O2 | C15 | sing | 1.45Å | 2.84Å | |
| C8 | O3 | doub | 1.21Å | 1.23Å | |
| C8 | C9 | sing | 1.49Å | 1.52Å | |
| C9 | O4 | doub | 1.21Å | 1.23Å | |
| C9 | C10 | sing | 1.51Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C13 | sing | 1.53Å | 1.50Å | |
| C10 | C14 | sing | 1.53Å | 1.50Å | |
| C11 | C12 | sing | 1.53Å | 1.56Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.11Å | |
| C12 | H123 | sing | 1.09Å | 1.12Å | |
| C13 | H131 | sing | 1.09Å | 1.11Å | |
| C13 | H132 | sing | 1.09Å | 1.12Å | |
| C13 | H133 | sing | 1.09Å | 1.12Å | |
| C14 | H141 | sing | 1.09Å | 1.11Å | |
| C14 | H142 | sing | 1.09Å | 1.12Å | |
| C14 | H143 | sing | 1.09Å | 1.11Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C15 | C24 | sing | 1.53Å | 1.51Å | |
| C15 | H15 | sing | 1.09Å | 1.12Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.12Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C17 | H171 | sing | 1.09Å | 1.12Å | |
| C17 | H172 | sing | 1.09Å | 1.11Å | |
| C18 | C19 | doub | 1.38Å | 1.33Å | Aromatic |
| C18 | C23 | sing | 1.38Å | 1.32Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.32Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.10Å | |
| C20 | C21 | doub | 1.38Å | 1.32Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.10Å | |
| C21 | C22 | sing | 1.38Å | 1.32Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.10Å | |
| C22 | C23 | doub | 1.38Å | 1.32Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å | |
| C23 | H23 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C24 | C29 | sing | 1.53Å | 1.52Å | |
| C24 | H24 | sing | 1.09Å | 1.11Å | |
| C25 | C26 | sing | 1.53Å | 1.50Å | |
| C25 | H251 | sing | 1.09Å | 1.12Å | |
| C25 | H252 | sing | 1.09Å | 1.12Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C26 | H261 | sing | 1.09Å | 1.11Å | |
| C26 | H262 | sing | 1.09Å | 1.11Å | |
| C27 | C28 | sing | 1.53Å | 1.51Å | |
| C27 | H271 | sing | 1.09Å | 1.11Å | |
| C27 | H272 | sing | 1.09Å | 1.12Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C28 | H281 | sing | 1.09Å | 1.11Å | |
| C28 | H282 | sing | 1.09Å | 1.11Å | |
| C29 | H291 | sing | 1.09Å | 1.12Å | |
| C29 | H292 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O1 | 113.5° | 120.0° |
| C2 | C1 | O2 | 120.3° | 120.0° |
| C1 | C2 | C3 | 109.9° | 109.6° |
| C1 | C2 | N7 | 119.8° | 109.8° |
| C1 | C2 | H2 | 100.7° | 109.6° |
| O1 | C1 | O2 | 126.2° | 120.0° |
| C1 | O2 | C15 | 58.6° | 120.0° |
| C3 | C2 | N7 | 106.0° | 109.0° |
| C3 | C2 | H2 | 115.9° | 109.6° |
| C2 | C3 | C4 | 112.9° | 109.4° |
| C2 | C3 | H31 | 111.0° | 109.6° |
| C2 | C3 | H32 | 111.0° | 109.4° |
| N7 | C2 | H2 | 105.0° | 109.3° |
| C2 | N7 | C6 | 114.5° | 118.8° |
| C2 | N7 | C8 | 120.0° | 120.6° |
| C4 | C3 | H31 | 110.9° | 109.5° |
| C4 | C3 | H32 | 111.0° | 109.5° |
| C3 | C4 | C5 | 105.4° | 109.5° |
| C3 | C4 | H41 | 113.7° | 109.5° |
| C3 | C4 | H42 | 113.7° | 109.5° |
| H31 | C3 | H32 | 99.3° | 109.6° |
| C5 | C4 | H41 | 113.8° | 109.5° |
| C5 | C4 | H42 | 113.8° | 109.5° |
| C4 | C5 | C6 | 110.9° | 109.3° |
| C4 | C5 | H51 | 111.7° | 109.5° |
| C4 | C5 | H52 | 111.7° | 109.5° |
| H41 | C4 | H42 | 96.7° | 109.4° |
| C6 | C5 | H51 | 111.7° | 109.5° |
| C6 | C5 | H52 | 111.7° | 109.5° |
| C5 | C6 | N7 | 105.3° | 108.8° |
| C5 | C6 | H61 | 113.7° | 109.6° |
| C5 | C6 | H62 | 113.7° | 109.6° |
| H51 | C5 | H52 | 98.7° | 109.5° |
| N7 | C6 | H61 | 113.8° | 109.5° |
| N7 | C6 | H62 | 113.8° | 109.6° |
| C6 | N7 | C8 | 124.8° | 120.6° |
| H61 | C6 | H62 | 96.8° | 109.7° |
| N7 | C8 | O3 | 118.2° | 120.0° |
| N7 | C8 | C9 | 125.9° | 120.0° |
| O2 | C15 | C16 | 107.3° | 109.5° |
| O2 | C15 | C24 | 143.7° | 109.5° |
| O2 | C15 | H15 | 74.5° | 109.4° |
| O3 | C8 | C9 | 115.8° | 120.0° |
| C8 | C9 | O4 | 115.5° | 120.0° |
| C8 | C9 | C10 | 124.2° | 120.0° |
| O4 | C9 | C10 | 120.1° | 120.0° |
| C9 | C10 | C11 | 113.9° | 109.5° |
| C9 | C10 | C13 | 109.7° | 109.5° |
| C9 | C10 | C14 | 112.5° | 109.5° |
| C11 | C10 | C13 | 108.9° | 109.4° |
| C11 | C10 | C14 | 109.2° | 109.5° |
| C10 | C11 | C12 | 115.0° | 109.5° |
| C10 | C11 | H111 | 110.1° | 109.5° |
| C10 | C11 | H112 | 110.2° | 109.5° |
| C13 | C10 | C14 | 101.9° | 109.5° |
| C10 | C13 | H131 | 109.6° | 109.5° |
| C10 | C13 | H132 | 112.1° | 109.5° |
| C10 | C13 | H133 | 112.1° | 109.5° |
| C10 | C14 | H141 | 112.5° | 109.5° |
| C10 | C14 | H142 | 111.1° | 109.5° |
| C10 | C14 | H143 | 111.1° | 109.5° |
| C12 | C11 | H111 | 110.2° | 109.5° |
| C12 | C11 | H112 | 110.2° | 109.5° |
| C11 | C12 | H121 | 115.0° | 109.5° |
| C11 | C12 | H122 | 110.2° | 109.5° |
| C11 | C12 | H123 | 110.2° | 109.5° |
| H111 | C11 | H112 | 100.1° | 109.4° |
| H121 | C12 | H122 | 110.2° | 109.5° |
| H121 | C12 | H123 | 110.2° | 109.4° |
| H122 | C12 | H123 | 100.0° | 109.5° |
| H131 | C13 | H132 | 112.2° | 109.5° |
| H131 | C13 | H133 | 112.2° | 109.5° |
| H132 | C13 | H133 | 98.3° | 109.4° |
| H141 | C14 | H142 | 111.1° | 109.5° |
| H141 | C14 | H143 | 111.2° | 109.5° |
| H142 | C14 | H143 | 99.2° | 109.4° |
| C16 | C15 | C24 | 108.8° | 109.5° |
| C16 | C15 | H15 | 171.1° | 109.5° |
| C15 | C16 | C17 | 114.0° | 109.4° |
| C15 | C16 | H161 | 110.6° | 109.5° |
| C15 | C16 | H162 | 110.5° | 109.5° |
| C24 | C15 | H15 | 70.4° | 109.4° |
| C15 | C24 | C25 | 116.2° | 109.5° |
| C15 | C24 | C29 | 112.5° | 109.5° |
| C15 | C24 | H24 | 103.0° | 109.6° |
| C17 | C16 | H161 | 110.5° | 109.5° |
| C17 | C16 | H162 | 110.5° | 109.5° |
| C16 | C17 | C18 | 119.9° | 109.4° |
| C16 | C17 | H171 | 108.5° | 109.5° |
| C16 | C17 | H172 | 108.5° | 109.5° |
| H161 | C16 | H162 | 99.8° | 109.4° |
| C18 | C17 | H171 | 108.5° | 109.5° |
| C18 | C17 | H172 | 108.5° | 109.5° |
| C17 | C18 | C19 | 119.9° | 120.0° |
| C17 | C18 | C23 | 120.2° | 120.0° |
| H171 | C17 | H172 | 101.5° | 109.5° |
| C19 | C18 | C23 | 119.4° | 120.0° |
| C18 | C19 | C20 | 120.8° | 120.0° |
| C18 | C19 | H19 | 119.9° | 120.0° |
| C18 | C23 | C22 | 120.0° | 120.0° |
| C18 | C23 | H23 | 119.9° | 120.0° |
| C20 | C19 | H19 | 119.4° | 120.0° |
| C19 | C20 | C21 | 119.3° | 120.0° |
| C19 | C20 | H20 | 120.4° | 120.0° |
| C21 | C20 | H20 | 120.3° | 120.0° |
| C20 | C21 | C22 | 120.2° | 120.0° |
| C20 | C21 | H21 | 119.9° | 120.0° |
| C22 | C21 | H21 | 119.9° | 120.0° |
| C21 | C22 | C23 | 120.3° | 120.0° |
| C21 | C22 | H22 | 119.9° | 120.0° |
| C23 | C22 | H22 | 119.8° | 120.0° |
| C22 | C23 | H23 | 120.0° | 120.0° |
| C25 | C24 | C29 | 112.1° | 109.5° |
| C25 | C24 | H24 | 103.6° | 109.5° |
| C24 | C25 | C26 | 106.0° | 109.5° |
| C24 | C25 | H251 | 113.5° | 109.5° |
| C24 | C25 | H252 | 113.5° | 109.5° |
| C29 | C24 | H24 | 108.2° | 109.4° |
| C24 | C29 | C28 | 109.5° | 109.5° |
| C24 | C29 | H291 | 112.2° | 109.4° |
| C24 | C29 | H292 | 112.2° | 109.5° |
| C26 | C25 | H251 | 113.6° | 109.5° |
| C26 | C25 | H252 | 113.6° | 109.5° |
| C25 | C26 | C27 | 110.9° | 109.5° |
| C25 | C26 | H261 | 111.6° | 109.5° |
| C25 | C26 | H262 | 111.6° | 109.5° |
| H251 | C25 | H252 | 96.9° | 109.5° |
| C27 | C26 | H261 | 111.7° | 109.4° |
| C27 | C26 | H262 | 111.7° | 109.5° |
| C26 | C27 | C28 | 112.8° | 109.4° |
| C26 | C27 | H271 | 111.0° | 109.4° |
| C26 | C27 | H272 | 111.0° | 109.4° |
| H261 | C26 | H262 | 98.7° | 109.5° |
| C28 | C27 | H271 | 111.1° | 109.5° |
| C28 | C27 | H272 | 111.0° | 109.4° |
| C27 | C28 | C29 | 107.7° | 109.5° |
| C27 | C28 | H281 | 112.8° | 109.4° |
| C27 | C28 | H282 | 112.8° | 109.4° |
| H271 | C27 | H272 | 99.3° | 109.5° |
| C29 | C28 | H281 | 112.8° | 109.5° |
| C29 | C28 | H282 | 112.9° | 109.4° |
| C28 | C29 | H291 | 112.2° | 109.5° |
| C28 | C29 | H292 | 112.2° | 109.5° |
| H281 | C28 | H282 | 97.7° | 109.5° |
| H291 | C29 | H292 | 98.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O1 | O2 | 179.8° | 180.0° |
| C1 | C2 | C3 | N7 | 130.8° | 120.2° |
| C1 | C2 | C3 | H2 | 113.2° | 120.3° |
| C1 | C2 | N7 | H2 | 112.0° | 120.2° |
| C1 | C2 | C3 | C4 | 72.9° | 174.6° |
| C1 | C2 | C3 | H31 | 52.3° | 65.4° |
| C1 | C2 | C3 | H32 | 161.8° | 54.7° |
| C1 | C2 | N7 | C6 | 63.9° | 173.3° |
| C1 | C2 | N7 | C8 | 107.1° | 6.4° |
| C2 | C1 | O2 | C15 | 175.2° | 180.0° |
| O1 | C1 | C2 | C3 | 140.7° | 87.1° |
| O1 | C1 | C2 | N7 | 17.7° | 32.6° |
| O1 | C1 | C2 | H2 | 96.6° | 152.6° |
| O1 | C1 | O2 | C15 | 5.1° | 0.0° |
| O2 | C1 | C2 | C3 | 39.6° | 92.9° |
| O2 | C1 | C2 | N7 | 162.5° | 147.4° |
| O2 | C1 | C2 | H2 | 83.1° | 27.3° |
| C1 | O2 | C15 | C16 | 109.2° | 150.0° |
| C1 | O2 | C15 | C24 | 65.0° | 90.0° |
| C1 | O2 | C15 | H15 | 79.9° | 30.0° |
| C3 | C2 | N7 | H2 | 123.1° | 119.7° |
| C2 | C3 | C4 | H31 | 125.3° | 120.1° |
| C2 | C3 | C4 | H32 | 125.3° | 119.8° |
| C2 | C3 | H31 | H32 | 116.9° | 120.0° |
| C2 | C3 | C4 | C5 | 58.8° | 61.2° |
| C2 | C3 | C4 | H41 | 66.5° | 58.8° |
| C2 | C3 | C4 | H42 | 175.9° | 178.7° |
| C3 | C2 | N7 | C6 | 61.0° | 53.3° |
| C3 | C2 | N7 | C8 | 128.0° | 126.4° |
| N7 | C2 | C3 | C4 | 57.8° | 54.4° |
| N7 | C2 | C3 | H31 | 176.9° | 174.4° |
| N7 | C2 | C3 | H32 | 67.5° | 65.5° |
| C2 | N7 | C6 | C5 | 63.8° | 53.3° |
| C2 | N7 | C6 | C8 | 170.5° | 179.7° |
| C2 | N7 | C6 | H61 | 61.4° | 66.5° |
| C2 | N7 | C6 | H62 | 171.0° | 173.2° |
| C2 | N7 | C8 | O3 | 1.3° | 34.8° |
| C2 | N7 | C8 | C9 | 174.5° | 145.3° |
| H2 | C2 | C3 | C4 | 173.8° | 65.2° |
| H2 | C2 | C3 | H31 | 60.9° | 54.8° |
| H2 | C2 | C3 | H32 | 48.5° | 175.0° |
| H2 | C2 | N7 | C6 | 175.9° | 66.5° |
| H2 | C2 | N7 | C8 | 4.9° | 113.9° |
| C4 | C3 | H31 | H32 | 116.8° | 120.0° |
| C3 | C4 | C5 | H41 | 125.3° | 120.0° |
| C3 | C4 | C5 | H42 | 125.2° | 120.0° |
| C3 | C4 | H41 | H42 | 119.6° | 120.0° |
| C3 | C4 | C5 | C6 | 61.0° | 61.4° |
| C3 | C4 | C5 | H51 | 173.8° | 178.7° |
| C3 | C4 | C5 | H52 | 64.3° | 58.6° |
| H31 | C3 | C4 | C5 | 175.9° | 178.7° |
| H31 | C3 | C4 | H41 | 58.8° | 61.3° |
| H31 | C3 | C4 | H42 | 50.6° | 58.6° |
| H32 | C3 | C4 | C5 | 66.6° | 58.6° |
| H32 | C3 | C4 | H41 | 168.2° | 178.6° |
| H32 | C3 | C4 | H42 | 58.7° | 61.5° |
| C5 | C4 | H41 | H42 | 119.7° | 120.0° |
| C4 | C5 | C6 | H51 | 125.3° | 119.9° |
| C4 | C5 | C6 | H52 | 125.2° | 120.0° |
| C4 | C5 | H51 | H52 | 117.5° | 120.1° |
| C4 | C5 | C6 | N7 | 62.7° | 54.6° |
| C4 | C5 | C6 | H61 | 62.6° | 65.1° |
| C4 | C5 | C6 | H62 | 172.1° | 174.5° |
| H41 | C4 | C5 | C6 | 64.3° | 58.6° |
| H41 | C4 | C5 | H51 | 61.0° | 61.3° |
| H41 | C4 | C5 | H52 | 170.4° | 178.6° |
| H42 | C4 | C5 | C6 | 173.8° | 178.6° |
| H42 | C4 | C5 | H51 | 48.5° | 58.6° |
| H42 | C4 | C5 | H52 | 60.9° | 61.5° |
| C6 | C5 | H51 | H52 | 117.6° | 120.0° |
| C5 | C6 | N7 | H61 | 125.2° | 119.8° |
| C5 | C6 | N7 | H62 | 125.2° | 119.9° |
| C5 | C6 | H61 | H62 | 119.7° | 120.4° |
| C5 | C6 | N7 | C8 | 125.7° | 126.4° |
| H51 | C5 | C6 | N7 | 172.1° | 174.6° |
| H51 | C5 | C6 | H61 | 62.7° | 54.8° |
| H51 | C5 | C6 | H62 | 46.8° | 65.6° |
| H52 | C5 | C6 | N7 | 62.6° | 65.4° |
| H52 | C5 | C6 | H61 | 172.2° | 174.9° |
| H52 | C5 | C6 | H62 | 62.7° | 54.5° |
| N7 | C6 | H61 | H62 | 119.8° | 120.3° |
| C6 | N7 | C8 | O3 | 168.7° | 145.5° |
| C6 | N7 | C8 | C9 | 15.4° | 34.3° |
| H61 | C6 | N7 | C8 | 109.1° | 113.9° |
| H62 | C6 | N7 | C8 | 0.5° | 6.5° |
| N7 | C8 | O3 | C9 | 176.3° | 179.9° |
| N7 | C8 | C9 | O4 | 86.0° | 6.3° |
| N7 | C8 | C9 | C10 | 99.4° | 173.8° |
| O2 | C15 | C16 | C24 | 176.4° | 120.0° |
| O2 | C15 | C16 | H15 | 99.9° | 120.0° |
| O2 | C15 | C24 | H15 | 15.2° | 120.0° |
| O2 | C15 | C16 | C17 | 82.6° | 60.0° |
| O2 | C15 | C16 | H161 | 152.2° | 180.0° |
| O2 | C15 | C16 | H162 | 42.7° | 60.0° |
| O2 | C15 | C24 | C25 | 27.8° | 59.9° |
| O2 | C15 | C24 | C29 | 103.4° | 60.1° |
| O2 | C15 | C24 | H24 | 140.3° | 180.0° |
| O3 | C8 | C9 | O4 | 89.9° | 173.8° |
| O3 | C8 | C9 | C10 | 84.7° | 6.1° |
| C8 | C9 | O4 | C10 | 174.8° | 179.9° |
| C8 | C9 | C10 | C11 | 1.1° | 179.9° |
| C8 | C9 | C10 | C13 | 123.5° | 59.9° |
| C8 | C9 | C10 | C14 | 123.8° | 60.1° |
| O4 | C9 | C10 | C11 | 173.2° | 0.0° |
| O4 | C9 | C10 | C13 | 50.8° | 120.0° |
| O4 | C9 | C10 | C14 | 61.8° | 120.0° |
| C9 | C10 | C11 | C13 | 122.8° | 120.0° |
| C9 | C10 | C11 | C14 | 126.7° | 120.0° |
| C9 | C10 | C13 | C14 | 119.4° | 120.0° |
| C9 | C10 | C11 | C12 | 77.2° | 180.0° |
| C9 | C10 | C11 | H111 | 48.1° | 60.0° |
| C9 | C10 | C11 | H112 | 157.5° | 60.0° |
| C9 | C10 | C13 | H131 | 180.0° | 60.0° |
| C9 | C10 | C13 | H132 | 54.7° | 180.0° |
| C9 | C10 | C13 | H133 | 54.7° | 60.0° |
| C9 | C10 | C14 | H141 | 180.0° | 60.0° |
| C9 | C10 | C14 | H142 | 54.7° | 60.0° |
| C9 | C10 | C14 | H143 | 54.7° | 180.0° |
| C11 | C10 | C13 | C14 | 115.3° | 120.0° |
| C10 | C11 | C12 | H111 | 125.2° | 120.0° |
| C10 | C11 | C12 | H112 | 125.3° | 120.0° |
| C10 | C11 | H111 | H112 | 116.0° | 120.0° |
| C10 | C11 | C12 | H121 | 180.0° | 180.0° |
| C10 | C11 | C12 | H122 | 54.7° | 60.0° |
| C10 | C11 | C12 | H123 | 54.7° | 60.1° |
| C11 | C10 | C13 | H131 | 54.7° | 60.0° |
| C11 | C10 | C13 | H132 | 180.0° | 60.0° |
| C11 | C10 | C13 | H133 | 70.6° | 180.0° |
| C11 | C10 | C14 | H141 | 52.5° | 60.1° |
| C11 | C10 | C14 | H142 | 72.8° | 179.9° |
| C11 | C10 | C14 | H143 | 177.8° | 60.0° |
| C13 | C10 | C11 | C12 | 45.6° | 60.0° |
| C13 | C10 | C11 | H111 | 170.8° | 180.0° |
| C13 | C10 | C11 | H112 | 79.7° | 60.0° |
| C10 | C13 | H131 | H132 | 125.2° | 120.0° |
| C10 | C13 | H131 | H133 | 125.3° | 120.0° |
| C10 | C13 | H132 | H133 | 118.0° | 120.0° |
| C13 | C10 | C14 | H141 | 62.6° | 180.0° |
| C13 | C10 | C14 | H142 | 172.1° | 60.0° |
| C13 | C10 | C14 | H143 | 62.7° | 60.0° |
| C14 | C10 | C11 | C12 | 156.1° | 60.0° |
| C14 | C10 | C11 | H111 | 78.6° | 60.0° |
| C14 | C10 | C11 | H112 | 30.9° | 180.0° |
| C14 | C10 | C13 | H131 | 60.6° | 180.0° |
| C14 | C10 | C13 | H132 | 64.7° | 60.0° |
| C14 | C10 | C13 | H133 | 174.1° | 60.0° |
| C10 | C14 | H141 | H142 | 125.3° | 120.0° |
| C10 | C14 | H141 | H143 | 125.3° | 120.1° |
| C10 | C14 | H142 | H143 | 116.9° | 120.0° |
| C12 | C11 | H111 | H112 | 116.0° | 120.0° |
| C11 | C12 | H121 | H122 | 125.3° | 120.0° |
| C11 | C12 | H121 | H123 | 125.3° | 120.0° |
| C11 | C12 | H122 | H123 | 116.0° | 120.0° |
| H111 | C11 | C12 | H121 | 54.8° | 60.0° |
| H111 | C11 | C12 | H122 | 179.9° | 60.0° |
| H111 | C11 | C12 | H123 | 70.5° | 179.9° |
| H112 | C11 | C12 | H121 | 54.7° | 60.0° |
| H112 | C11 | C12 | H122 | 70.6° | 180.0° |
| H112 | C11 | C12 | H123 | 180.0° | 60.0° |
| H121 | C12 | H122 | H123 | 116.0° | 120.0° |
| H131 | C13 | H132 | H133 | 118.1° | 120.0° |
| H141 | C14 | H142 | H143 | 117.0° | 119.9° |
| C16 | C15 | C24 | H15 | 170.6° | 120.0° |
| C15 | C16 | C17 | H161 | 125.3° | 120.0° |
| C15 | C16 | C17 | H162 | 125.2° | 120.0° |
| C15 | C16 | H161 | H162 | 116.4° | 120.0° |
| C15 | C16 | C17 | C18 | 143.7° | 180.0° |
| C15 | C16 | C17 | H171 | 18.5° | 60.0° |
| C15 | C16 | C17 | H172 | 91.0° | 60.0° |
| C16 | C15 | C24 | C25 | 158.0° | 180.0° |
| C16 | C15 | C24 | C29 | 70.9° | 60.0° |
| C16 | C15 | C24 | H24 | 45.4° | 60.0° |
| C24 | C15 | C16 | C17 | 101.0° | 180.0° |
| C24 | C15 | C16 | H161 | 24.2° | 59.9° |
| C24 | C15 | C16 | H162 | 133.8° | 60.0° |
| C15 | C24 | C25 | C29 | 131.4° | 120.0° |
| C15 | C24 | C25 | H24 | 112.2° | 120.1° |
| C15 | C24 | C29 | H24 | 113.1° | 120.0° |
| C15 | C24 | C25 | C26 | 166.7° | 180.0° |
| C15 | C24 | C25 | H251 | 41.4° | 60.0° |
| C15 | C24 | C25 | H252 | 68.0° | 60.0° |
| C15 | C24 | C29 | C28 | 164.6° | 180.0° |
| C15 | C24 | C29 | H291 | 70.1° | 60.0° |
| C15 | C24 | C29 | H292 | 39.4° | 59.9° |
| H15 | C15 | C16 | C17 | 17.4° | 60.0° |
| H15 | C15 | C16 | H161 | 107.9° | 60.0° |
| H15 | C15 | C16 | H162 | 142.6° | 180.0° |
| H15 | C15 | C24 | C25 | 12.6° | 60.0° |
| H15 | C15 | C24 | C29 | 118.6° | 180.0° |
| H15 | C15 | C24 | H24 | 125.1° | 60.0° |
| C17 | C16 | H161 | H162 | 116.4° | 120.0° |
| C16 | C17 | C18 | H171 | 125.3° | 120.0° |
| C16 | C17 | C18 | H172 | 125.3° | 120.0° |
| C16 | C17 | H171 | H172 | 114.1° | 120.0° |
| C16 | C17 | C18 | C19 | 61.0° | 90.0° |
| C16 | C17 | C18 | C23 | 111.8° | 90.3° |
| H161 | C16 | C17 | C18 | 91.0° | 60.0° |
| H161 | C16 | C17 | H171 | 143.7° | 180.0° |
| H161 | C16 | C17 | H172 | 34.2° | 60.0° |
| H162 | C16 | C17 | C18 | 18.5° | 60.0° |
| H162 | C16 | C17 | H171 | 106.8° | 60.0° |
| H162 | C16 | C17 | H172 | 143.8° | 180.0° |
| C18 | C17 | H171 | H172 | 114.1° | 120.0° |
| C17 | C18 | C19 | C23 | 172.9° | 179.7° |
| C17 | C18 | C19 | C20 | 171.6° | 180.0° |
| C17 | C18 | C19 | H19 | 8.4° | 0.1° |
| C17 | C18 | C23 | C22 | 171.7° | 179.8° |
| C17 | C18 | C23 | H23 | 8.3° | 0.2° |
| H171 | C17 | C18 | C19 | 173.8° | 30.0° |
| H171 | C17 | C18 | C23 | 13.4° | 149.7° |
| H172 | C17 | C18 | C19 | 64.3° | 150.0° |
| H172 | C17 | C18 | C23 | 122.9° | 29.7° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.5° | 0.0° |
| C18 | C19 | C20 | H20 | 179.5° | 180.0° |
| C19 | C18 | C23 | C22 | 1.1° | 0.5° |
| C19 | C18 | C23 | H23 | 178.9° | 179.9° |
| C23 | C18 | C19 | C20 | 1.2° | 0.3° |
| C23 | C18 | C19 | H19 | 178.8° | 179.7° |
| C18 | C23 | C22 | C21 | 0.2° | 0.5° |
| C18 | C23 | C22 | H23 | 180.0° | 179.6° |
| C18 | C23 | C22 | H22 | 179.8° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.4° | 0.1° |
| C19 | C20 | C21 | H21 | 179.5° | 179.9° |
| H19 | C19 | C20 | C21 | 179.5° | 180.0° |
| H19 | C19 | C20 | H20 | 0.5° | 0.0° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.6° | 0.2° |
| C20 | C21 | C22 | H22 | 179.4° | 180.0° |
| H20 | C20 | C21 | C22 | 179.6° | 180.0° |
| H20 | C20 | C21 | H21 | 0.5° | 0.0° |
| C21 | C22 | C23 | H22 | 180.0° | 179.8° |
| C21 | C22 | C23 | H23 | 179.8° | 180.0° |
| H21 | C21 | C22 | C23 | 179.4° | 179.8° |
| H21 | C21 | C22 | H22 | 0.6° | 0.0° |
| H22 | C22 | C23 | H23 | 0.2° | 0.1° |
| C25 | C24 | C29 | H24 | 113.6° | 119.9° |
| C24 | C25 | C26 | H251 | 125.3° | 120.0° |
| C24 | C25 | C26 | H252 | 125.3° | 120.0° |
| C24 | C25 | H251 | H252 | 119.4° | 120.0° |
| C24 | C25 | C26 | C27 | 59.1° | 60.0° |
| C24 | C25 | C26 | H261 | 66.2° | 59.9° |
| C24 | C25 | C26 | H262 | 175.6° | 180.0° |
| C25 | C24 | C29 | C28 | 62.1° | 60.0° |
| C25 | C24 | C29 | H291 | 63.1° | 60.0° |
| C25 | C24 | C29 | H292 | 172.6° | 180.0° |
| C29 | C24 | C25 | C26 | 62.0° | 60.0° |
| C29 | C24 | C25 | H251 | 172.7° | 180.0° |
| C29 | C24 | C25 | H252 | 63.4° | 60.0° |
| C24 | C29 | C28 | C27 | 55.9° | 60.0° |
| C24 | C29 | C28 | H291 | 125.3° | 119.9° |
| C24 | C29 | C28 | H292 | 125.3° | 120.0° |
| C24 | C29 | C28 | H281 | 69.3° | 60.0° |
| C24 | C29 | C28 | H282 | 178.8° | 180.0° |
| C24 | C29 | H291 | H292 | 118.1° | 120.0° |
| H24 | C24 | C25 | C26 | 54.5° | 59.9° |
| H24 | C24 | C25 | H251 | 70.8° | 60.1° |
| H24 | C24 | C25 | H252 | 179.8° | 179.9° |
| H24 | C24 | C29 | C28 | 51.5° | 60.0° |
| H24 | C24 | C29 | H291 | 176.8° | 179.9° |
| H24 | C24 | C29 | H292 | 73.8° | 60.1° |
| C26 | C25 | H251 | H252 | 119.5° | 120.0° |
| C25 | C26 | C27 | H261 | 125.2° | 119.9° |
| C25 | C26 | C27 | H262 | 125.2° | 120.0° |
| C25 | C26 | H261 | H262 | 117.5° | 120.0° |
| C25 | C26 | C27 | C28 | 59.6° | 59.9° |
| C25 | C26 | C27 | H271 | 175.2° | 180.0° |
| C25 | C26 | C27 | H272 | 65.7° | 60.0° |
| H251 | C25 | C26 | C27 | 175.6° | 180.0° |
| H251 | C25 | C26 | H261 | 59.1° | 60.1° |
| H251 | C25 | C26 | H262 | 50.4° | 60.0° |
| H252 | C25 | C26 | C27 | 66.2° | 60.0° |
| H252 | C25 | C26 | H261 | 168.5° | 179.9° |
| H252 | C25 | C26 | H262 | 59.0° | 60.0° |
| C27 | C26 | H261 | H262 | 117.6° | 120.0° |
| C26 | C27 | C28 | H271 | 125.2° | 120.0° |
| C26 | C27 | C28 | H272 | 125.2° | 119.9° |
| C26 | C27 | H271 | H272 | 116.8° | 120.0° |
| C26 | C27 | C28 | C29 | 55.8° | 60.0° |
| C26 | C27 | C28 | H281 | 69.4° | 60.1° |
| C26 | C27 | C28 | H282 | 178.9° | 180.0° |
| H261 | C26 | C27 | C28 | 65.7° | 60.0° |
| H261 | C26 | C27 | H271 | 59.6° | 60.0° |
| H261 | C26 | C27 | H272 | 169.0° | 179.9° |
| H262 | C26 | C27 | C28 | 175.2° | 180.0° |
| H262 | C26 | C27 | H271 | 49.9° | 60.0° |
| H262 | C26 | C27 | H272 | 59.5° | 60.0° |
| C28 | C27 | H271 | H272 | 116.9° | 120.0° |
| C27 | C28 | C29 | H281 | 125.2° | 120.0° |
| C27 | C28 | C29 | H282 | 125.2° | 120.0° |
| C27 | C28 | H281 | H282 | 118.8° | 119.9° |
| C27 | C28 | C29 | H291 | 69.3° | 59.9° |
| C27 | C28 | C29 | H292 | 178.8° | 180.0° |
| H271 | C27 | C28 | C29 | 178.9° | 180.0° |
| H271 | C27 | C28 | H281 | 55.9° | 59.9° |
| H271 | C27 | C28 | H282 | 53.7° | 60.0° |
| H272 | C27 | C28 | C29 | 69.4° | 59.9° |
| H272 | C27 | C28 | H281 | 165.4° | 180.0° |
| H272 | C27 | C28 | H282 | 55.8° | 60.1° |
| C29 | C28 | H281 | H282 | 118.8° | 120.0° |
| C28 | C29 | H291 | H292 | 118.1° | 120.1° |
| H281 | C28 | C29 | H291 | 165.4° | 180.0° |
| H281 | C28 | C29 | H292 | 56.0° | 60.0° |
| H282 | C28 | C29 | H291 | 55.9° | 60.1° |
| H282 | C28 | C29 | H292 | 53.6° | 60.0° |
