0SM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O3P | sing | 1.43Å | 1.44Å | |
| C1 | CBV | sing | 1.53Å | 1.54Å | |
| C3 | CBU | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | O4P | sing | 1.43Å | 1.43Å | |
| C5 | N | sing | 1.47Å | 1.48Å | |
| C6 | N | sing | 1.47Å | 1.48Å | |
| C7 | N | sing | 1.47Å | 1.47Å | |
| C8 | N | sing | 1.47Å | 1.48Å | |
| C11 | C12 | sing | 1.51Å | 1.55Å | |
| C11 | O11 | doub | 1.21Å | 1.23Å | |
| C11 | NBQ | sing | 1.35Å | 1.34Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C27 | C28 | sing | 1.53Å | 1.53Å | |
| O2 | CBU | sing | 1.43Å | 1.44Å | |
| O1P | P | sing | 1.61Å | 1.62Å | |
| O2P | P | doub | 1.48Å | 1.48Å | |
| O3P | P | sing | 1.61Å | 1.61Å | |
| O4P | P | sing | 1.61Å | 1.63Å | |
| NBQ | CBV | sing | 1.46Å | 1.49Å | |
| CBV | CBU | sing | 1.53Å | 1.56Å | |
| C1 | H11C | sing | 1.09Å | 1.10Å | |
| C1 | H12C | sing | 1.09Å | 1.10Å | |
| CBV | HBV | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C3 | H33C | sing | 1.09Å | 1.10Å | |
| CBU | HBU | sing | 1.09Å | 1.10Å | |
| C4 | H41C | sing | 1.09Å | 1.10Å | |
| C4 | H42C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C6 | H63C | sing | 1.09Å | 1.10Å | |
| C7 | H71C | sing | 1.09Å | 1.10Å | |
| C7 | H72C | sing | 1.09Å | 1.10Å | |
| C7 | H73C | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C8 | H83C | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| NBQ | HBQ | sing | 0.97Å | 1.00Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| O2 | H2 | sing | 0.97Å | 0.95Å | |
| O1P | H1P | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3P | C1 | CBV | 113.6° | 109.5° |
| C1 | O3P | P | 120.5° | 123.0° |
| O3P | C1 | H11C | 108.4° | 109.5° |
| O3P | C1 | H12C | 108.5° | 109.5° |
| C1 | CBV | NBQ | 105.3° | 109.5° |
| C1 | CBV | CBU | 113.5° | 109.4° |
| CBV | C1 | H11C | 108.5° | 109.4° |
| CBV | C1 | H12C | 108.4° | 109.5° |
| C1 | CBV | HBV | 106.1° | 109.5° |
| C3 | CBU | O2 | 107.0° | 109.5° |
| C3 | CBU | CBV | 116.9° | 109.4° |
| CBU | C3 | H31C | 109.5° | 109.5° |
| CBU | C3 | H32C | 109.5° | 109.4° |
| CBU | C3 | H33C | 109.5° | 109.5° |
| C3 | CBU | HBU | 106.7° | 109.5° |
| C5 | C4 | O4P | 110.0° | 109.5° |
| C4 | C5 | N | 117.7° | 109.5° |
| C5 | C4 | H41C | 109.3° | 109.4° |
| C5 | C4 | H42C | 109.4° | 109.5° |
| C4 | C5 | H51C | 107.4° | 109.5° |
| C4 | C5 | H52C | 107.4° | 109.5° |
| C4 | O4P | P | 121.8° | 123.0° |
| O4P | C4 | H41C | 109.4° | 109.5° |
| O4P | C4 | H42C | 109.4° | 109.5° |
| C5 | N | C6 | 111.5° | 109.5° |
| C5 | N | C7 | 114.6° | 109.5° |
| C5 | N | C8 | 107.4° | 109.5° |
| N | C5 | H51C | 107.4° | 109.5° |
| N | C5 | H52C | 107.4° | 109.4° |
| C6 | N | C7 | 108.3° | 109.5° |
| C6 | N | C8 | 106.9° | 109.5° |
| N | C6 | H61C | 109.5° | 109.5° |
| N | C6 | H62C | 109.5° | 109.5° |
| N | C6 | H63C | 109.4° | 109.4° |
| C7 | N | C8 | 107.7° | 109.5° |
| N | C7 | H71C | 109.5° | 109.5° |
| N | C7 | H72C | 109.5° | 109.5° |
| N | C7 | H73C | 109.5° | 109.4° |
| N | C8 | H81C | 109.5° | 109.5° |
| N | C8 | H82C | 109.5° | 109.5° |
| N | C8 | H83C | 109.4° | 109.5° |
| C12 | C11 | O11 | 118.4° | 120.0° |
| C12 | C11 | NBQ | 122.6° | 120.0° |
| C11 | C12 | C13 | 110.0° | 109.5° |
| C11 | C12 | H121 | 109.3° | 109.5° |
| C11 | C12 | H122 | 109.4° | 109.5° |
| O11 | C11 | NBQ | 119.0° | 120.0° |
| C11 | NBQ | CBV | 132.5° | 120.0° |
| C11 | NBQ | HBQ | 113.7° | 120.0° |
| C12 | C13 | C14 | 114.3° | 109.5° |
| C13 | C12 | H121 | 109.4° | 109.5° |
| C13 | C12 | H122 | 109.4° | 109.5° |
| C12 | C13 | H131 | 108.3° | 109.4° |
| C12 | C13 | H132 | 108.3° | 109.4° |
| C13 | C14 | C15 | 109.4° | 109.5° |
| C14 | C13 | H131 | 108.2° | 109.5° |
| C14 | C13 | H132 | 108.3° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C14 | C15 | C16 | 112.1° | 109.5° |
| C15 | C14 | H141 | 109.5° | 109.5° |
| C15 | C14 | H142 | 109.5° | 109.5° |
| C14 | C15 | H151 | 108.8° | 109.5° |
| C14 | C15 | H152 | 108.8° | 109.5° |
| C15 | C16 | C17 | 112.0° | 109.5° |
| C16 | C15 | H151 | 108.8° | 109.5° |
| C16 | C15 | H152 | 108.8° | 109.5° |
| C15 | C16 | H161 | 108.8° | 109.5° |
| C15 | C16 | H162 | 108.8° | 109.5° |
| C16 | C17 | C18 | 110.2° | 109.5° |
| C17 | C16 | H161 | 108.8° | 109.4° |
| C17 | C16 | H162 | 108.8° | 109.4° |
| C16 | C17 | H171 | 109.3° | 109.4° |
| C16 | C17 | H172 | 109.3° | 109.4° |
| C17 | C18 | C19 | 113.5° | 109.5° |
| C18 | C17 | H171 | 109.3° | 109.5° |
| C18 | C17 | H172 | 109.3° | 109.5° |
| C17 | C18 | H181 | 108.5° | 109.4° |
| C17 | C18 | H182 | 108.5° | 109.5° |
| C18 | C19 | C20 | 108.3° | 109.5° |
| C19 | C18 | H181 | 108.4° | 109.5° |
| C19 | C18 | H182 | 108.5° | 109.5° |
| C18 | C19 | H191 | 109.8° | 109.5° |
| C18 | C19 | H192 | 109.8° | 109.5° |
| C19 | C20 | C21 | 113.7° | 109.5° |
| C20 | C19 | H191 | 109.8° | 109.5° |
| C20 | C19 | H192 | 109.8° | 109.5° |
| C19 | C20 | H201 | 108.4° | 109.5° |
| C19 | C20 | H202 | 108.4° | 109.5° |
| C20 | C21 | C22 | 115.7° | 109.5° |
| C21 | C20 | H201 | 108.4° | 109.4° |
| C21 | C20 | H202 | 108.4° | 109.4° |
| C20 | C21 | H211 | 107.9° | 109.4° |
| C20 | C21 | H212 | 107.9° | 109.5° |
| C21 | C22 | C23 | 110.8° | 109.5° |
| C22 | C21 | H211 | 107.9° | 109.5° |
| C22 | C21 | H212 | 107.9° | 109.5° |
| C21 | C22 | H221 | 109.1° | 109.5° |
| C21 | C22 | H222 | 109.1° | 109.5° |
| C22 | C23 | C24 | 113.0° | 109.5° |
| C23 | C22 | H221 | 109.1° | 109.4° |
| C23 | C22 | H222 | 109.1° | 109.5° |
| C22 | C23 | H231 | 108.6° | 109.5° |
| C22 | C23 | H232 | 108.6° | 109.5° |
| C23 | C24 | C25 | 109.9° | 109.5° |
| C24 | C23 | H231 | 108.6° | 109.5° |
| C24 | C23 | H232 | 108.6° | 109.5° |
| C23 | C24 | H241 | 109.4° | 109.4° |
| C23 | C24 | H242 | 109.4° | 109.4° |
| C24 | C25 | C26 | 112.1° | 109.5° |
| C25 | C24 | H241 | 109.4° | 109.5° |
| C25 | C24 | H242 | 109.4° | 109.5° |
| C24 | C25 | H251 | 108.8° | 109.5° |
| C24 | C25 | H252 | 108.8° | 109.5° |
| C25 | C26 | C27 | 111.4° | 109.5° |
| C26 | C25 | H251 | 108.8° | 109.4° |
| C26 | C25 | H252 | 108.8° | 109.5° |
| C25 | C26 | H261 | 109.0° | 109.5° |
| C25 | C26 | H262 | 109.0° | 109.5° |
| C26 | C27 | C28 | 112.1° | 109.4° |
| C27 | C26 | H261 | 109.0° | 109.4° |
| C27 | C26 | H262 | 109.0° | 109.5° |
| C26 | C27 | H271 | 108.8° | 109.5° |
| C26 | C27 | H272 | 108.8° | 109.4° |
| C28 | C27 | H271 | 108.8° | 109.5° |
| C28 | C27 | H272 | 108.8° | 109.5° |
| C27 | C28 | H281 | 109.5° | 109.5° |
| C27 | C28 | H282 | 109.5° | 109.4° |
| C27 | C28 | H283 | 109.4° | 109.4° |
| O2 | CBU | CBV | 111.7° | 109.5° |
| O2 | CBU | HBU | 107.8° | 109.5° |
| CBU | O2 | H2 | 109.5° | 114.0° |
| O1P | P | O2P | 109.2° | 109.5° |
| O1P | P | O3P | 105.9° | 109.5° |
| O1P | P | O4P | 109.6° | 109.5° |
| P | O1P | H1P | 109.5° | 114.0° |
| O2P | P | O3P | 111.2° | 109.5° |
| O2P | P | O4P | 112.4° | 109.5° |
| O3P | P | O4P | 108.3° | 109.4° |
| NBQ | CBV | CBU | 118.7° | 109.5° |
| NBQ | CBV | HBV | 106.6° | 109.5° |
| CBV | NBQ | HBQ | 113.8° | 120.1° |
| CBU | CBV | HBV | 105.9° | 109.5° |
| CBV | CBU | HBU | 106.4° | 109.5° |
| H11C | C1 | H12C | 109.5° | 109.5° |
| H31C | C3 | H32C | 109.4° | 109.4° |
| H31C | C3 | H33C | 109.5° | 109.5° |
| H32C | C3 | H33C | 109.4° | 109.5° |
| H41C | C4 | H42C | 109.4° | 109.5° |
| H51C | C5 | H52C | 109.5° | 109.4° |
| H61C | C6 | H62C | 109.5° | 109.5° |
| H61C | C6 | H63C | 109.4° | 109.5° |
| H62C | C6 | H63C | 109.5° | 109.5° |
| H71C | C7 | H72C | 109.5° | 109.5° |
| H71C | C7 | H73C | 109.5° | 109.5° |
| H72C | C7 | H73C | 109.5° | 109.5° |
| H81C | C8 | H82C | 109.5° | 109.5° |
| H81C | C8 | H83C | 109.4° | 109.5° |
| H82C | C8 | H83C | 109.5° | 109.4° |
| H121 | C12 | H122 | 109.4° | 109.4° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H151 | C15 | H152 | 109.5° | 109.4° |
| H161 | C16 | H162 | 109.5° | 109.4° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.5° | 109.4° |
| H201 | C20 | H202 | 109.5° | 109.4° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| H221 | C22 | H222 | 109.4° | 109.4° |
| H231 | C23 | H232 | 109.4° | 109.4° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H261 | C26 | H262 | 109.4° | 109.5° |
| H271 | C27 | H272 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.4° | 109.5° |
| H281 | C28 | H283 | 109.5° | 109.5° |
| H282 | C28 | H283 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3P | C1 | CBV | H11C | 120.6° | 120.0° |
| O3P | C1 | CBV | H12C | 120.6° | 120.0° |
| C1 | O3P | P | O1P | 112.7° | 65.0° |
| C1 | O3P | P | O2P | 5.9° | 55.0° |
| C1 | O3P | P | O4P | 129.9° | 175.0° |
| O3P | C1 | CBV | NBQ | 148.6° | 65.0° |
| O3P | C1 | CBV | CBU | 80.0° | 55.0° |
| O3P | C1 | H11C | H12C | 118.1° | 120.0° |
| O3P | C1 | CBV | HBV | 35.9° | 174.9° |
| C1 | CBV | CBU | C3 | 51.1° | 180.0° |
| C1 | CBV | NBQ | C11 | 157.2° | 155.0° |
| C1 | CBV | CBU | O2 | 72.6° | 60.0° |
| CBV | C1 | O3P | P | 104.4° | 180.0° |
| C1 | CBV | NBQ | CBU | 128.4° | 119.9° |
| C1 | CBV | NBQ | HBV | 112.4° | 120.1° |
| C1 | CBV | CBU | HBV | 115.9° | 120.0° |
| CBV | C1 | H11C | H12C | 118.1° | 120.0° |
| C1 | CBV | CBU | HBU | 170.1° | 60.1° |
| C1 | CBV | NBQ | HBQ | 22.8° | 24.9° |
| C3 | CBU | O2 | CBV | 129.1° | 120.0° |
| C3 | CBU | O2 | HBU | 114.4° | 120.0° |
| C3 | CBU | CBV | NBQ | 73.4° | 60.1° |
| C3 | CBU | CBV | HBU | 119.0° | 119.9° |
| C3 | CBU | CBV | HBV | 167.0° | 60.0° |
| CBU | C3 | H31C | H32C | 120.0° | 119.9° |
| CBU | C3 | H31C | H33C | 120.1° | 120.0° |
| CBU | C3 | H32C | H33C | 120.0° | 119.9° |
| C3 | CBU | O2 | H2 | 180.0° | 60.0° |
| C5 | C4 | O4P | H41C | 120.1° | 120.0° |
| C5 | C4 | O4P | H42C | 120.1° | 120.0° |
| C4 | C5 | N | H51C | 121.2° | 120.1° |
| C4 | C5 | N | H52C | 121.2° | 120.0° |
| C4 | C5 | N | C6 | 63.3° | 54.4° |
| C4 | C5 | N | C7 | 60.3° | 174.5° |
| C4 | C5 | N | C8 | 179.9° | 65.5° |
| C5 | C4 | O4P | P | 179.4° | 180.0° |
| C5 | C4 | H41C | H42C | 119.8° | 120.0° |
| C4 | C5 | H51C | H52C | 116.3° | 120.1° |
| O4P | C4 | C5 | N | 179.6° | 66.5° |
| C4 | O4P | P | O1P | 2.2° | 65.1° |
| C4 | O4P | P | O2P | 119.4° | 55.0° |
| C4 | O4P | P | O3P | 117.3° | 175.0° |
| O4P | C4 | H41C | H42C | 119.8° | 120.1° |
| O4P | C4 | C5 | H51C | 59.2° | 173.4° |
| O4P | C4 | C5 | H52C | 58.4° | 53.4° |
| C5 | N | C6 | C7 | 127.0° | 120.0° |
| C5 | N | C6 | C8 | 117.1° | 120.0° |
| C5 | N | C7 | C8 | 119.4° | 120.0° |
| N | C5 | C4 | H41C | 60.3° | 173.5° |
| N | C5 | C4 | H42C | 59.5° | 53.5° |
| N | C5 | H51C | H52C | 116.3° | 119.9° |
| C5 | N | C6 | H61C | 180.0° | 60.0° |
| C5 | N | C6 | H62C | 60.0° | 180.0° |
| C5 | N | C6 | H63C | 60.0° | 60.0° |
| C5 | N | C7 | H71C | 180.0° | 60.0° |
| C5 | N | C7 | H72C | 60.0° | 180.0° |
| C5 | N | C7 | H73C | 60.0° | 60.0° |
| C5 | N | C8 | H81C | 180.0° | 71.0° |
| C5 | N | C8 | H82C | 60.0° | 169.0° |
| C5 | N | C8 | H83C | 60.0° | 49.0° |
| C6 | N | C7 | C8 | 115.4° | 120.0° |
| C6 | N | C5 | H51C | 57.9° | 65.6° |
| C6 | N | C5 | H52C | 175.5° | 174.4° |
| N | C6 | H61C | H62C | 120.0° | 120.0° |
| N | C6 | H61C | H63C | 120.0° | 120.0° |
| N | C6 | H62C | H63C | 120.0° | 120.0° |
| C6 | N | C7 | H71C | 54.8° | 180.0° |
| C6 | N | C7 | H72C | 174.8° | 60.0° |
| C6 | N | C7 | H73C | 65.2° | 60.0° |
| C6 | N | C8 | H81C | 60.2° | 49.0° |
| C6 | N | C8 | H82C | 59.8° | 71.0° |
| C6 | N | C8 | H83C | 179.8° | 169.0° |
| C7 | N | C5 | H51C | 178.6° | 54.4° |
| C7 | N | C5 | H52C | 60.9° | 65.5° |
| C7 | N | C6 | H61C | 53.0° | 60.0° |
| C7 | N | C6 | H62C | 67.0° | 60.0° |
| C7 | N | C6 | H63C | 172.9° | 179.9° |
| N | C7 | H71C | H72C | 120.0° | 120.0° |
| N | C7 | H71C | H73C | 120.0° | 120.0° |
| N | C7 | H72C | H73C | 120.0° | 120.0° |
| C7 | N | C8 | H81C | 56.1° | 169.0° |
| C7 | N | C8 | H82C | 176.1° | 49.0° |
| C7 | N | C8 | H83C | 63.9° | 71.0° |
| C8 | N | C5 | H51C | 58.9° | 174.4° |
| C8 | N | C5 | H52C | 58.7° | 54.5° |
| C8 | N | C6 | H61C | 62.9° | 180.0° |
| C8 | N | C6 | H62C | 177.1° | 60.0° |
| C8 | N | C6 | H63C | 57.0° | 60.0° |
| C8 | N | C7 | H71C | 60.6° | 60.0° |
| C8 | N | C7 | H72C | 59.4° | 60.0° |
| C8 | N | C7 | H73C | 179.4° | 180.0° |
| N | C8 | H81C | H82C | 120.0° | 120.0° |
| N | C8 | H81C | H83C | 120.0° | 120.0° |
| N | C8 | H82C | H83C | 120.0° | 120.0° |
| C12 | C11 | O11 | NBQ | 180.0° | 179.9° |
| C11 | C12 | C13 | H121 | 120.1° | 120.0° |
| C11 | C12 | C13 | H122 | 120.1° | 120.0° |
| C11 | C12 | C13 | C14 | 140.2° | 180.0° |
| C12 | C11 | NBQ | CBV | 61.4° | 180.0° |
| C11 | C12 | H121 | H122 | 119.7° | 119.9° |
| C12 | C11 | NBQ | HBQ | 118.6° | 0.1° |
| C11 | C12 | C13 | H131 | 99.1° | 60.0° |
| C11 | C12 | C13 | H132 | 19.4° | 60.0° |
| O11 | C11 | C12 | C13 | 103.3° | 0.0° |
| O11 | C11 | NBQ | CBV | 118.7° | 0.1° |
| O11 | C11 | C12 | H121 | 16.8° | 120.0° |
| O11 | C11 | C12 | H122 | 136.6° | 120.1° |
| O11 | C11 | NBQ | HBQ | 61.3° | 180.0° |
| NBQ | C11 | C12 | C13 | 76.7° | 180.0° |
| C11 | NBQ | CBV | HBQ | 180.0° | 179.9° |
| C11 | NBQ | CBV | CBU | 74.4° | 85.1° |
| C11 | NBQ | CBV | HBV | 44.9° | 34.9° |
| NBQ | C11 | C12 | H121 | 163.2° | 59.9° |
| NBQ | C11 | C12 | H122 | 43.4° | 60.0° |
| C12 | C13 | C14 | H131 | 120.7° | 120.0° |
| C12 | C13 | C14 | H132 | 120.7° | 120.0° |
| C12 | C13 | C14 | C15 | 81.0° | 180.0° |
| C13 | C12 | H121 | H122 | 119.8° | 120.0° |
| C12 | C13 | H131 | H132 | 117.8° | 119.9° |
| C12 | C13 | C14 | H141 | 39.1° | 60.0° |
| C12 | C13 | C14 | H142 | 159.1° | 60.0° |
| C13 | C14 | C15 | H141 | 120.0° | 120.0° |
| C13 | C14 | C15 | H142 | 120.0° | 120.0° |
| C13 | C14 | C15 | C16 | 169.2° | 180.0° |
| C14 | C13 | C12 | H121 | 20.1° | 60.0° |
| C14 | C13 | C12 | H122 | 99.7° | 60.0° |
| C14 | C13 | H131 | H132 | 117.8° | 120.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | C15 | H151 | 70.5° | 60.0° |
| C13 | C14 | C15 | H152 | 48.8° | 60.0° |
| C14 | C15 | C16 | H151 | 120.4° | 120.0° |
| C14 | C15 | C16 | H152 | 120.4° | 120.0° |
| C14 | C15 | C16 | C17 | 73.3° | 180.0° |
| C15 | C14 | C13 | H131 | 158.3° | 60.0° |
| C15 | C14 | C13 | H132 | 39.8° | 60.0° |
| C15 | C14 | H141 | H142 | 120.0° | 120.0° |
| C14 | C15 | H151 | H152 | 118.8° | 120.0° |
| C14 | C15 | C16 | H161 | 166.3° | 60.0° |
| C14 | C15 | C16 | H162 | 47.1° | 60.0° |
| C15 | C16 | C17 | H161 | 120.4° | 120.1° |
| C15 | C16 | C17 | H162 | 120.4° | 120.0° |
| C15 | C16 | C17 | C18 | 179.5° | 180.0° |
| C16 | C15 | C14 | H141 | 49.1° | 60.0° |
| C16 | C15 | C14 | H142 | 70.9° | 60.0° |
| C16 | C15 | H151 | H152 | 118.8° | 120.0° |
| C15 | C16 | H161 | H162 | 118.8° | 120.0° |
| C15 | C16 | C17 | H171 | 59.4° | 60.0° |
| C15 | C16 | C17 | H172 | 60.4° | 60.0° |
| C16 | C17 | C18 | H171 | 120.1° | 119.9° |
| C16 | C17 | C18 | H172 | 120.1° | 120.0° |
| C16 | C17 | C18 | C19 | 170.8° | 180.0° |
| C17 | C16 | C15 | H151 | 47.0° | 60.0° |
| C17 | C16 | C15 | H152 | 166.3° | 60.0° |
| C17 | C16 | H161 | H162 | 118.8° | 119.9° |
| C16 | C17 | H171 | H172 | 119.7° | 119.9° |
| C16 | C17 | C18 | H181 | 68.6° | 60.0° |
| C16 | C17 | C18 | H182 | 50.2° | 60.0° |
| C17 | C18 | C19 | H181 | 120.6° | 119.9° |
| C17 | C18 | C19 | H182 | 120.6° | 120.1° |
| C17 | C18 | C19 | C20 | 152.8° | 180.0° |
| C18 | C17 | C16 | H161 | 60.2° | 60.0° |
| C18 | C17 | C16 | H162 | 59.1° | 59.9° |
| C18 | C17 | H171 | H172 | 119.7° | 120.1° |
| C17 | C18 | H181 | H182 | 118.2° | 120.0° |
| C17 | C18 | C19 | H191 | 87.4° | 60.0° |
| C17 | C18 | C19 | H192 | 33.0° | 60.0° |
| C18 | C19 | C20 | H191 | 119.8° | 120.0° |
| C18 | C19 | C20 | H192 | 119.8° | 120.0° |
| C18 | C19 | C20 | C21 | 76.0° | 180.0° |
| C19 | C18 | C17 | H171 | 50.7° | 60.1° |
| C19 | C18 | C17 | H172 | 69.1° | 60.0° |
| C19 | C18 | H181 | H182 | 118.2° | 120.0° |
| C18 | C19 | H191 | H192 | 120.5° | 120.0° |
| C18 | C19 | C20 | H201 | 163.4° | 60.0° |
| C18 | C19 | C20 | H202 | 44.6° | 60.0° |
| C19 | C20 | C21 | H201 | 120.6° | 120.0° |
| C19 | C20 | C21 | H202 | 120.6° | 120.0° |
| C19 | C20 | C21 | C22 | 175.5° | 180.0° |
| C20 | C19 | C18 | H181 | 32.2° | 60.0° |
| C20 | C19 | C18 | H182 | 86.6° | 60.0° |
| C20 | C19 | H191 | H192 | 120.6° | 120.0° |
| C19 | C20 | H201 | H202 | 118.1° | 120.0° |
| C19 | C20 | C21 | H211 | 63.6° | 59.9° |
| C19 | C20 | C21 | H212 | 54.6° | 60.0° |
| C20 | C21 | C22 | H211 | 120.9° | 120.0° |
| C20 | C21 | C22 | H212 | 120.9° | 120.0° |
| C20 | C21 | C22 | C23 | 34.4° | 180.0° |
| C21 | C20 | C19 | H191 | 43.8° | 60.0° |
| C21 | C20 | C19 | H192 | 164.2° | 60.0° |
| C21 | C20 | H201 | H202 | 118.0° | 119.9° |
| C20 | C21 | H211 | H212 | 117.2° | 120.0° |
| C20 | C21 | C22 | H221 | 85.9° | 60.0° |
| C20 | C21 | C22 | H222 | 154.6° | 60.0° |
| C21 | C22 | C23 | H221 | 120.2° | 120.0° |
| C21 | C22 | C23 | H222 | 120.2° | 120.0° |
| C21 | C22 | C23 | C24 | 110.2° | 180.0° |
| C22 | C21 | C20 | H201 | 54.9° | 60.0° |
| C22 | C21 | C20 | H202 | 63.9° | 60.0° |
| C22 | C21 | H211 | H212 | 117.2° | 120.0° |
| C21 | C22 | H221 | H222 | 119.4° | 120.0° |
| C21 | C22 | C23 | H231 | 10.3° | 60.0° |
| C21 | C22 | C23 | H232 | 129.2° | 60.0° |
| C22 | C23 | C24 | H231 | 120.6° | 120.0° |
| C22 | C23 | C24 | H232 | 120.5° | 120.0° |
| C22 | C23 | C24 | C25 | 178.4° | 180.0° |
| C23 | C22 | C21 | H211 | 155.3° | 60.0° |
| C23 | C22 | C21 | H212 | 86.5° | 60.0° |
| C23 | C22 | H221 | H222 | 119.4° | 120.0° |
| C22 | C23 | H231 | H232 | 118.4° | 120.0° |
| C22 | C23 | C24 | H241 | 58.3° | 60.0° |
| C22 | C23 | C24 | H242 | 61.6° | 60.0° |
| C23 | C24 | C25 | H241 | 120.1° | 120.0° |
| C23 | C24 | C25 | H242 | 120.1° | 120.0° |
| C23 | C24 | C25 | C26 | 119.0° | 180.0° |
| C24 | C23 | C22 | H221 | 129.5° | 60.0° |
| C24 | C23 | C22 | H222 | 10.0° | 60.0° |
| C24 | C23 | H231 | H232 | 118.4° | 119.9° |
| C23 | C24 | H241 | H242 | 119.8° | 119.9° |
| C23 | C24 | C25 | H251 | 1.4° | 60.0° |
| C23 | C24 | C25 | H252 | 120.7° | 60.0° |
| C24 | C25 | C26 | H251 | 120.4° | 120.0° |
| C24 | C25 | C26 | H252 | 120.4° | 120.0° |
| C24 | C25 | C26 | C27 | 166.0° | 180.0° |
| C25 | C24 | C23 | H231 | 61.1° | 60.0° |
| C25 | C24 | C23 | H232 | 57.9° | 60.0° |
| C25 | C24 | H241 | H242 | 119.8° | 120.0° |
| C24 | C25 | H251 | H252 | 118.8° | 120.0° |
| C24 | C25 | C26 | H261 | 45.7° | 60.1° |
| C24 | C25 | C26 | H262 | 73.6° | 60.0° |
| C25 | C26 | C27 | H261 | 120.3° | 120.0° |
| C25 | C26 | C27 | H262 | 120.3° | 120.0° |
| C25 | C26 | C27 | C28 | 58.8° | 179.9° |
| C26 | C25 | C24 | H241 | 121.0° | 60.0° |
| C26 | C25 | C24 | H242 | 1.1° | 60.0° |
| C26 | C25 | H251 | H252 | 118.8° | 120.0° |
| C25 | C26 | H261 | H262 | 119.1° | 120.0° |
| C25 | C26 | C27 | H271 | 179.2° | 60.0° |
| C25 | C26 | C27 | H272 | 61.6° | 60.0° |
| C26 | C27 | C28 | H271 | 120.4° | 120.0° |
| C26 | C27 | C28 | H272 | 120.4° | 119.9° |
| C27 | C26 | C25 | H251 | 73.6° | 60.0° |
| C27 | C26 | C25 | H252 | 45.7° | 60.0° |
| C27 | C26 | H261 | H262 | 119.1° | 120.0° |
| C26 | C27 | H271 | H272 | 118.8° | 119.9° |
| C26 | C27 | C28 | H281 | 180.0° | 60.0° |
| C26 | C27 | C28 | H282 | 60.0° | 60.1° |
| C26 | C27 | C28 | H283 | 60.0° | 180.0° |
| C28 | C27 | C26 | H261 | 61.5° | 60.0° |
| C28 | C27 | C26 | H262 | 179.1° | 60.1° |
| C28 | C27 | H271 | H272 | 118.8° | 120.0° |
| C27 | C28 | H281 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H283 | 120.0° | 120.0° |
| C27 | C28 | H282 | H283 | 120.0° | 119.9° |
| O2 | CBU | CBV | NBQ | 163.0° | 60.0° |
| O2 | CBU | CBV | HBU | 117.4° | 120.0° |
| O2 | CBU | CBV | HBV | 43.4° | 180.0° |
| O2 | CBU | C3 | H31C | 180.0° | 180.0° |
| O2 | CBU | C3 | H32C | 60.0° | 60.0° |
| O2 | CBU | C3 | H33C | 60.0° | 60.0° |
| O1P | P | O2P | O3P | 116.5° | 120.0° |
| O1P | P | O2P | O4P | 121.8° | 120.0° |
| O1P | P | O3P | O4P | 117.5° | 120.0° |
| O2P | P | O3P | O4P | 124.0° | 120.0° |
| O2P | P | O1P | H1P | 0.0° | 180.0° |
| P | O3P | C1 | H11C | 16.2° | 60.0° |
| P | O3P | C1 | H12C | 135.0° | 60.0° |
| O3P | P | O1P | H1P | 119.9° | 60.0° |
| P | O4P | C4 | H41C | 60.6° | 60.0° |
| P | O4P | C4 | H42C | 59.3° | 60.0° |
| O4P | P | O1P | H1P | 123.5° | 60.0° |
| NBQ | CBV | CBU | HBV | 119.6° | 120.1° |
| NBQ | CBV | C1 | H11C | 90.8° | 55.1° |
| NBQ | CBV | C1 | H12C | 28.0° | 175.0° |
| NBQ | CBV | CBU | HBU | 45.6° | 180.0° |
| CBU | CBV | C1 | H11C | 40.6° | 175.0° |
| CBU | CBV | C1 | H12C | 159.4° | 65.1° |
| CBV | CBU | C3 | H31C | 54.0° | 60.0° |
| CBV | CBU | C3 | H32C | 174.0° | 180.0° |
| CBV | CBU | C3 | H33C | 66.0° | 60.1° |
| CBU | CBV | NBQ | HBQ | 105.6° | 95.0° |
| CBV | CBU | O2 | H2 | 51.0° | 180.0° |
| H11C | C1 | CBV | HBV | 156.5° | 65.0° |
| H12C | C1 | CBV | HBV | 84.8° | 54.9° |
| HBV | CBV | CBU | HBU | 74.0° | 59.9° |
| HBV | CBV | NBQ | HBQ | 135.1° | 145.0° |
| H31C | C3 | H32C | H33C | 120.0° | 120.1° |
| H31C | C3 | CBU | HBU | 64.9° | 59.9° |
| H32C | C3 | CBU | HBU | 55.1° | 60.0° |
| H33C | C3 | CBU | HBU | 175.1° | 180.0° |
| HBU | CBU | O2 | H2 | 65.6° | 60.0° |
| H41C | C4 | C5 | H51C | 60.9° | 53.4° |
| H41C | C4 | C5 | H52C | 178.5° | 66.6° |
| H42C | C4 | C5 | H51C | 179.3° | 66.5° |
| H42C | C4 | C5 | H52C | 61.7° | 173.5° |
| H61C | C6 | H62C | H63C | 120.0° | 120.0° |
| H71C | C7 | H72C | H73C | 120.0° | 120.0° |
| H81C | C8 | H82C | H83C | 120.0° | 120.0° |
| H121 | C12 | C13 | H131 | 140.8° | 180.0° |
| H121 | C12 | C13 | H132 | 100.6° | 60.0° |
| H122 | C12 | C13 | H131 | 21.0° | 60.0° |
| H122 | C12 | C13 | H132 | 139.5° | 180.0° |
| H131 | C13 | C14 | H141 | 81.6° | 180.0° |
| H131 | C13 | C14 | H142 | 38.3° | 60.0° |
| H132 | C13 | C14 | H141 | 159.8° | 60.0° |
| H132 | C13 | C14 | H142 | 80.2° | 179.9° |
| H141 | C14 | C15 | H151 | 169.5° | 180.0° |
| H141 | C14 | C15 | H152 | 71.2° | 60.0° |
| H142 | C14 | C15 | H151 | 49.5° | 60.0° |
| H142 | C14 | C15 | H152 | 168.7° | 180.0° |
| H151 | C15 | C16 | H161 | 73.3° | 180.0° |
| H151 | C15 | C16 | H162 | 167.4° | 60.0° |
| H152 | C15 | C16 | H161 | 45.9° | 60.0° |
| H152 | C15 | C16 | H162 | 73.3° | 180.0° |
| H161 | C16 | C17 | H171 | 179.7° | 179.9° |
| H161 | C16 | C17 | H172 | 59.9° | 60.1° |
| H162 | C16 | C17 | H171 | 61.0° | 60.0° |
| H162 | C16 | C17 | H172 | 179.2° | 180.0° |
| H171 | C17 | C18 | H181 | 171.3° | 180.0° |
| H171 | C17 | C18 | H182 | 69.9° | 60.0° |
| H172 | C17 | C18 | H181 | 51.5° | 60.0° |
| H172 | C17 | C18 | H182 | 170.3° | 180.0° |
| H181 | C18 | C19 | H191 | 152.0° | 179.9° |
| H181 | C18 | C19 | H192 | 87.6° | 60.0° |
| H182 | C18 | C19 | H191 | 33.2° | 60.0° |
| H182 | C18 | C19 | H192 | 153.6° | 180.0° |
| H191 | C19 | C20 | H201 | 76.8° | 180.0° |
| H191 | C19 | C20 | H202 | 164.4° | 60.0° |
| H192 | C19 | C20 | H201 | 43.5° | 60.0° |
| H192 | C19 | C20 | H202 | 75.2° | 180.0° |
| H201 | C20 | C21 | H211 | 175.8° | 180.0° |
| H201 | C20 | C21 | H212 | 66.0° | 60.0° |
| H202 | C20 | C21 | H211 | 57.0° | 60.1° |
| H202 | C20 | C21 | H212 | 175.2° | 180.0° |
| H211 | C21 | C22 | H221 | 35.0° | 180.0° |
| H211 | C21 | C22 | H222 | 84.5° | 60.0° |
| H212 | C21 | C22 | H221 | 153.2° | 60.0° |
| H212 | C21 | C22 | H222 | 33.7° | 180.0° |
| H221 | C22 | C23 | H231 | 109.9° | 180.0° |
| H221 | C22 | C23 | H232 | 9.0° | 60.0° |
| H222 | C22 | C23 | H231 | 130.5° | 60.0° |
| H222 | C22 | C23 | H232 | 110.6° | 180.0° |
| H231 | C23 | C24 | H241 | 178.9° | 180.0° |
| H231 | C23 | C24 | H242 | 59.0° | 60.0° |
| H232 | C23 | C24 | H241 | 62.2° | 60.1° |
| H232 | C23 | C24 | H242 | 177.9° | 180.0° |
| H241 | C24 | C25 | H251 | 118.6° | 180.0° |
| H241 | C24 | C25 | H252 | 0.6° | 60.0° |
| H242 | C24 | C25 | H251 | 121.5° | 59.9° |
| H242 | C24 | C25 | H252 | 119.3° | 179.9° |
| H251 | C25 | C26 | H261 | 166.1° | 180.0° |
| H251 | C25 | C26 | H262 | 46.7° | 60.0° |
| H252 | C25 | C26 | H261 | 74.6° | 60.0° |
| H252 | C25 | C26 | H262 | 166.0° | 180.0° |
| H261 | C26 | C27 | H271 | 58.9° | 180.0° |
| H261 | C26 | C27 | H272 | 178.1° | 60.0° |
| H262 | C26 | C27 | H271 | 60.5° | 60.0° |
| H262 | C26 | C27 | H272 | 58.7° | 180.0° |
| H271 | C27 | C28 | H281 | 59.6° | 180.0° |
| H271 | C27 | C28 | H282 | 179.6° | 60.0° |
| H271 | C27 | C28 | H283 | 60.4° | 60.0° |
| H272 | C27 | C28 | H281 | 59.6° | 60.0° |
| H272 | C27 | C28 | H282 | 60.4° | 180.0° |
| H272 | C27 | C28 | H283 | 179.6° | 60.1° |
| H281 | C28 | H282 | H283 | 120.0° | 120.1° |
