PSC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P | O11 | sing | 1.61Å | 1.65Å | |
| P | O12 | sing | 1.61Å | 1.66Å | |
| P | O13 | sing | 1.61Å | 1.50Å | |
| P | O14 | doub | 1.48Å | 1.50Å | |
| N | C05 | sing | 1.47Å | 1.47Å | |
| N | C06 | sing | 1.47Å | 1.50Å | |
| N | C07 | sing | 1.47Å | 1.48Å | |
| N | C08 | sing | 1.47Å | 1.50Å | |
| C01 | C02 | sing | 1.53Å | 1.56Å | |
| C01 | O03 | sing | 1.45Å | 1.44Å | |
| C01 | H011 | sing | 1.09Å | 1.11Å | |
| C01 | H012 | sing | 1.09Å | 1.12Å | |
| C02 | C03 | sing | 1.53Å | 1.55Å | |
| C02 | O01 | sing | 1.45Å | 1.46Å | |
| C02 | H02 | sing | 1.09Å | 1.11Å | |
| C03 | O11 | sing | 1.43Å | 1.45Å | |
| C03 | H031 | sing | 1.09Å | 1.12Å | |
| C03 | H032 | sing | 1.09Å | 1.12Å | |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| C04 | O12 | sing | 1.43Å | 1.45Å | |
| C04 | H041 | sing | 1.09Å | 1.12Å | |
| C04 | H042 | sing | 1.09Å | 1.12Å | |
| C05 | H051 | sing | 1.09Å | 1.12Å | |
| C05 | H052 | sing | 1.09Å | 1.11Å | |
| C06 | H061 | sing | 1.09Å | 1.12Å | |
| C06 | H062 | sing | 1.09Å | 1.12Å | |
| C06 | H063 | sing | 1.09Å | 1.11Å | |
| C07 | H071 | sing | 1.09Å | 1.12Å | |
| C07 | H072 | sing | 1.09Å | 1.11Å | |
| C07 | H073 | sing | 1.09Å | 1.12Å | |
| C08 | H081 | sing | 1.09Å | 1.12Å | |
| C08 | H082 | sing | 1.09Å | 1.11Å | |
| C08 | H083 | sing | 1.09Å | 1.11Å | |
| O01 | C1 | sing | 1.34Å | 1.37Å | |
| O02 | C1 | doub | 1.21Å | 1.22Å | |
| O03 | C19 | sing | 1.34Å | 1.37Å | |
| O04 | C19 | doub | 1.21Å | 1.23Å | |
| O13 | H13 | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.51Å | 1.57Å | |
| C2 | C3 | sing | 1.53Å | 1.57Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.53Å | 1.57Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.53Å | 1.55Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C5 | H51 | sing | 1.09Å | 1.12Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | C7 | sing | 1.53Å | 1.55Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.12Å | |
| C8 | C9 | sing | 1.51Å | 1.56Å | |
| C8 | H81 | sing | 1.09Å | 1.11Å | |
| C8 | H82 | sing | 1.09Å | 1.11Å | |
| C9 | C10 | doub | 1.31Å | 1.56Å | |
| C9 | H9 | sing | 1.08Å | 1.10Å | |
| C10 | C11 | sing | 1.51Å | 1.57Å | |
| C10 | H10 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | sing | 1.51Å | 1.55Å | |
| C11 | H111 | sing | 1.09Å | 1.11Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | C13 | doub | 1.31Å | 1.55Å | |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| C13 | C14 | sing | 1.51Å | 1.56Å | |
| C13 | H1 | sing | 1.08Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.57Å | |
| C14 | H141 | sing | 1.09Å | 1.12Å | |
| C14 | H142 | sing | 1.09Å | 1.12Å | |
| C15 | C16 | sing | 1.53Å | 1.57Å | |
| C15 | H151 | sing | 1.09Å | 1.12Å | |
| C15 | H152 | sing | 1.09Å | 1.12Å | |
| C16 | C17 | sing | 1.53Å | 1.58Å | |
| C16 | H161 | sing | 1.09Å | 1.12Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | C18 | sing | 1.53Å | 1.56Å | |
| C17 | H171 | sing | 1.09Å | 1.11Å | |
| C17 | H172 | sing | 1.09Å | 1.12Å | |
| C18 | H181 | sing | 1.09Å | 1.12Å | |
| C18 | H182 | sing | 1.09Å | 1.12Å | |
| C18 | H183 | sing | 1.09Å | 1.11Å | |
| C19 | C20 | sing | 1.51Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | H201 | sing | 1.09Å | 1.11Å | |
| C20 | H202 | sing | 1.09Å | 1.11Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C21 | H211 | sing | 1.09Å | 1.12Å | |
| C21 | H212 | sing | 1.09Å | 1.11Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C23 | H231 | sing | 1.09Å | 1.11Å | |
| C23 | H232 | sing | 1.09Å | 1.11Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C24 | H241 | sing | 1.09Å | 1.11Å | |
| C24 | H242 | sing | 1.09Å | 1.12Å | |
| C25 | C26 | sing | 1.53Å | 1.49Å | |
| C25 | H251 | sing | 1.09Å | 1.12Å | |
| C25 | H252 | sing | 1.09Å | 1.11Å | |
| C26 | C27 | sing | 1.53Å | 1.49Å | |
| C26 | H261 | sing | 1.09Å | 1.12Å | |
| C26 | H262 | sing | 1.09Å | 1.11Å | |
| C27 | C28 | sing | 1.53Å | 1.50Å | |
| C27 | H271 | sing | 1.09Å | 1.12Å | |
| C27 | H272 | sing | 1.09Å | 1.12Å | |
| C28 | C29 | sing | 1.53Å | 1.49Å | |
| C28 | H281 | sing | 1.09Å | 1.11Å | |
| C28 | H282 | sing | 1.09Å | 1.12Å | |
| C29 | C30 | sing | 1.53Å | 1.50Å | |
| C29 | H291 | sing | 1.09Å | 1.12Å | |
| C29 | H292 | sing | 1.09Å | 1.11Å | |
| C30 | C31 | sing | 1.53Å | 1.51Å | |
| C30 | H301 | sing | 1.09Å | 1.12Å | |
| C30 | H302 | sing | 1.09Å | 1.12Å | |
| C31 | C32 | sing | 1.53Å | 1.50Å | |
| C31 | H311 | sing | 1.09Å | 1.12Å | |
| C31 | H312 | sing | 1.09Å | 1.11Å | |
| C32 | C33 | sing | 1.53Å | 1.53Å | |
| C32 | H321 | sing | 1.09Å | 1.11Å | |
| C32 | H322 | sing | 1.09Å | 1.12Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C33 | H331 | sing | 1.09Å | 1.12Å | |
| C33 | H332 | sing | 1.09Å | 1.11Å | |
| C34 | H341 | sing | 1.09Å | 1.11Å | |
| C34 | H342 | sing | 1.09Å | 1.12Å | |
| C34 | H343 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O11 | P | O12 | 102.2° | 109.5° |
| O11 | P | O13 | 108.8° | 109.5° |
| O11 | P | O14 | 109.0° | 109.4° |
| P | O11 | C03 | 127.7° | 106.8° |
| O12 | P | O13 | 108.8° | 109.5° |
| O12 | P | O14 | 110.1° | 109.5° |
| P | O12 | C04 | 131.7° | 106.8° |
| O13 | P | O14 | 117.0° | 109.5° |
| P | O13 | H13 | 108.8° | 106.8° |
| C05 | N | C06 | 114.2° | 109.5° |
| C05 | N | C07 | 108.1° | 109.5° |
| C05 | N | C08 | 110.4° | 109.5° |
| N | C05 | C04 | 113.0° | 109.5° |
| N | C05 | H051 | 110.9° | 109.5° |
| N | C05 | H052 | 110.9° | 109.4° |
| C06 | N | C07 | 105.1° | 109.5° |
| C06 | N | C08 | 112.1° | 109.5° |
| N | C06 | H061 | 114.2° | 109.4° |
| N | C06 | H062 | 110.5° | 109.5° |
| N | C06 | H063 | 110.5° | 109.5° |
| C07 | N | C08 | 106.6° | 109.4° |
| N | C07 | H071 | 108.0° | 109.5° |
| N | C07 | H072 | 112.7° | 109.5° |
| N | C07 | H073 | 112.7° | 109.5° |
| N | C08 | H081 | 110.4° | 109.5° |
| N | C08 | H082 | 111.9° | 109.5° |
| N | C08 | H083 | 111.9° | 109.5° |
| C02 | C01 | O03 | 111.5° | 109.5° |
| C02 | C01 | H011 | 111.4° | 109.5° |
| C02 | C01 | H012 | 111.5° | 109.5° |
| C01 | C02 | C03 | 113.9° | 109.5° |
| C01 | C02 | O01 | 112.9° | 109.5° |
| C01 | C02 | H02 | 104.8° | 109.5° |
| O03 | C01 | H011 | 111.5° | 109.5° |
| O03 | C01 | H012 | 111.5° | 109.4° |
| C01 | O03 | C19 | 107.3° | 120.0° |
| H011 | C01 | H012 | 98.9° | 109.4° |
| C03 | C02 | O01 | 112.4° | 109.4° |
| C03 | C02 | H02 | 105.3° | 109.5° |
| C02 | C03 | O11 | 111.1° | 109.5° |
| C02 | C03 | H031 | 111.6° | 109.5° |
| C02 | C03 | H032 | 111.6° | 109.5° |
| O01 | C02 | H02 | 106.6° | 109.5° |
| C02 | O01 | C1 | 119.7° | 120.0° |
| O11 | C03 | H031 | 111.7° | 109.4° |
| O11 | C03 | H032 | 111.6° | 109.5° |
| H031 | C03 | H032 | 98.7° | 109.5° |
| C05 | C04 | O12 | 112.6° | 109.5° |
| C05 | C04 | H041 | 111.1° | 109.5° |
| C05 | C04 | H042 | 111.1° | 109.4° |
| C04 | C05 | H051 | 110.9° | 109.5° |
| C04 | C05 | H052 | 110.9° | 109.5° |
| O12 | C04 | H041 | 111.0° | 109.5° |
| O12 | C04 | H042 | 111.1° | 109.5° |
| H041 | C04 | H042 | 99.2° | 109.5° |
| H051 | C05 | H052 | 99.4° | 109.5° |
| H061 | C06 | H062 | 110.5° | 109.5° |
| H061 | C06 | H063 | 110.4° | 109.5° |
| H062 | C06 | H063 | 99.8° | 109.5° |
| H071 | C07 | H072 | 112.8° | 109.5° |
| H071 | C07 | H073 | 112.7° | 109.4° |
| H072 | C07 | H073 | 97.7° | 109.5° |
| H081 | C08 | H082 | 111.8° | 109.4° |
| H081 | C08 | H083 | 111.9° | 109.5° |
| H082 | C08 | H083 | 98.6° | 109.5° |
| O01 | C1 | O02 | 124.6° | 120.0° |
| O01 | C1 | C2 | 109.0° | 120.0° |
| O02 | C1 | C2 | 124.9° | 120.0° |
| O03 | C19 | O04 | 127.1° | 120.0° |
| O03 | C19 | C20 | 108.0° | 120.0° |
| O04 | C19 | C20 | 124.8° | 120.0° |
| C1 | C2 | C3 | 117.8° | 109.5° |
| C1 | C2 | H21 | 109.2° | 109.5° |
| C1 | C2 | H22 | 109.2° | 109.5° |
| C3 | C2 | H21 | 109.2° | 109.5° |
| C3 | C2 | H22 | 109.2° | 109.5° |
| C2 | C3 | C4 | 115.1° | 109.5° |
| C2 | C3 | H31 | 110.2° | 109.5° |
| C2 | C3 | H32 | 110.2° | 109.5° |
| H21 | C2 | H22 | 100.9° | 109.4° |
| C4 | C3 | H31 | 110.2° | 109.5° |
| C4 | C3 | H32 | 110.2° | 109.5° |
| C3 | C4 | C5 | 117.3° | 109.5° |
| C3 | C4 | H41 | 109.3° | 109.5° |
| C3 | C4 | H42 | 109.4° | 109.5° |
| H31 | C3 | H32 | 100.0° | 109.5° |
| C5 | C4 | H41 | 109.4° | 109.5° |
| C5 | C4 | H42 | 109.4° | 109.5° |
| C4 | C5 | C6 | 116.7° | 109.5° |
| C4 | C5 | H51 | 109.6° | 109.5° |
| C4 | C5 | H52 | 109.6° | 109.5° |
| H41 | C4 | H42 | 100.8° | 109.5° |
| C6 | C5 | H51 | 109.6° | 109.5° |
| C6 | C5 | H52 | 109.6° | 109.5° |
| C5 | C6 | C7 | 114.4° | 109.5° |
| C5 | C6 | H61 | 110.4° | 109.5° |
| C5 | C6 | H62 | 110.4° | 109.5° |
| H51 | C5 | H52 | 100.5° | 109.5° |
| C7 | C6 | H61 | 110.4° | 109.5° |
| C7 | C6 | H62 | 110.4° | 109.5° |
| C6 | C7 | C8 | 117.2° | 109.5° |
| C6 | C7 | H71 | 109.4° | 109.5° |
| C6 | C7 | H72 | 109.5° | 109.5° |
| H61 | C6 | H62 | 99.9° | 109.5° |
| C8 | C7 | H71 | 109.4° | 109.5° |
| C8 | C7 | H72 | 109.4° | 109.5° |
| C7 | C8 | C9 | 113.5° | 109.5° |
| C7 | C8 | H81 | 110.7° | 109.5° |
| C7 | C8 | H82 | 110.8° | 109.5° |
| H71 | C7 | H72 | 100.7° | 109.5° |
| C9 | C8 | H81 | 110.7° | 109.5° |
| C9 | C8 | H82 | 110.7° | 109.5° |
| C8 | C9 | C10 | 120.5° | 120.0° |
| C8 | C9 | H9 | 119.8° | 120.0° |
| H81 | C8 | H82 | 99.6° | 109.5° |
| C10 | C9 | H9 | 119.7° | 120.0° |
| C9 | C10 | C11 | 122.9° | 120.0° |
| C9 | C10 | H10 | 118.2° | 120.0° |
| C11 | C10 | H10 | 119.0° | 120.0° |
| C10 | C11 | C12 | 114.0° | 109.5° |
| C10 | C11 | H111 | 110.6° | 109.5° |
| C10 | C11 | H112 | 110.5° | 109.4° |
| C12 | C11 | H111 | 110.6° | 109.5° |
| C12 | C11 | H112 | 110.6° | 109.5° |
| C11 | C12 | C13 | 118.8° | 120.0° |
| C11 | C12 | H12 | 120.7° | 120.0° |
| H111 | C11 | H112 | 99.8° | 109.5° |
| C13 | C12 | H12 | 120.5° | 120.0° |
| C12 | C13 | C14 | 110.7° | 120.0° |
| C12 | C13 | H1 | 124.5° | 120.0° |
| C14 | C13 | H1 | 124.8° | 120.0° |
| C13 | C14 | C15 | 126.3° | 109.5° |
| C13 | C14 | H141 | 106.3° | 109.4° |
| C13 | C14 | H142 | 106.3° | 109.5° |
| C15 | C14 | H141 | 106.3° | 109.4° |
| C15 | C14 | H142 | 106.3° | 109.4° |
| C14 | C15 | C16 | 126.7° | 109.5° |
| C14 | C15 | H151 | 106.2° | 109.4° |
| C14 | C15 | H152 | 106.2° | 109.4° |
| H141 | C14 | H142 | 103.1° | 109.5° |
| C16 | C15 | H151 | 106.2° | 109.5° |
| C16 | C15 | H152 | 106.2° | 109.5° |
| C15 | C16 | C17 | 116.3° | 109.4° |
| C15 | C16 | H161 | 109.7° | 109.5° |
| C15 | C16 | H162 | 109.7° | 109.5° |
| H151 | C15 | H152 | 103.2° | 109.5° |
| C17 | C16 | H161 | 109.7° | 109.4° |
| C17 | C16 | H162 | 109.7° | 109.5° |
| C16 | C17 | C18 | 122.4° | 109.5° |
| C16 | C17 | H171 | 107.6° | 109.5° |
| C16 | C17 | H172 | 107.6° | 109.5° |
| H161 | C16 | H162 | 100.5° | 109.5° |
| C18 | C17 | H171 | 107.6° | 109.4° |
| C18 | C17 | H172 | 107.6° | 109.5° |
| C17 | C18 | H181 | 122.4° | 109.5° |
| C17 | C18 | H182 | 107.6° | 109.5° |
| C17 | C18 | H183 | 107.7° | 109.5° |
| H171 | C17 | H172 | 102.2° | 109.5° |
| H181 | C18 | H182 | 107.6° | 109.4° |
| H181 | C18 | H183 | 107.7° | 109.5° |
| H182 | C18 | H183 | 102.2° | 109.5° |
| C19 | C20 | C21 | 112.1° | 109.5° |
| C19 | C20 | H201 | 111.3° | 109.4° |
| C19 | C20 | H202 | 111.3° | 109.5° |
| C21 | C20 | H201 | 111.2° | 109.5° |
| C21 | C20 | H202 | 111.2° | 109.5° |
| C20 | C21 | C22 | 115.9° | 109.4° |
| C20 | C21 | H211 | 109.9° | 109.5° |
| C20 | C21 | H212 | 109.9° | 109.5° |
| H201 | C20 | H202 | 99.1° | 109.4° |
| C22 | C21 | H211 | 109.9° | 109.5° |
| C22 | C21 | H212 | 109.9° | 109.5° |
| C21 | C22 | C23 | 113.7° | 109.4° |
| C21 | C22 | H221 | 110.7° | 109.5° |
| C21 | C22 | H222 | 110.7° | 109.5° |
| H211 | C21 | H212 | 100.3° | 109.6° |
| C23 | C22 | H221 | 110.6° | 109.5° |
| C23 | C22 | H222 | 110.7° | 109.4° |
| C22 | C23 | C24 | 113.3° | 109.5° |
| C22 | C23 | H231 | 110.8° | 109.5° |
| C22 | C23 | H232 | 110.8° | 109.4° |
| H221 | C22 | H222 | 99.6° | 109.4° |
| C24 | C23 | H231 | 110.8° | 109.5° |
| C24 | C23 | H232 | 110.8° | 109.4° |
| C23 | C24 | C25 | 111.6° | 109.4° |
| C23 | C24 | H241 | 111.5° | 109.5° |
| C23 | C24 | H242 | 111.4° | 109.5° |
| H231 | C23 | H232 | 99.6° | 109.6° |
| C25 | C24 | H241 | 111.4° | 109.5° |
| C25 | C24 | H242 | 111.4° | 109.4° |
| C24 | C25 | C26 | 109.8° | 109.4° |
| C24 | C25 | H251 | 112.1° | 109.5° |
| C24 | C25 | H252 | 112.1° | 109.4° |
| H241 | C24 | H242 | 98.9° | 109.5° |
| C26 | C25 | H251 | 112.1° | 109.5° |
| C26 | C25 | H252 | 112.1° | 109.4° |
| C25 | C26 | C27 | 109.5° | 109.5° |
| C25 | C26 | H261 | 112.2° | 109.5° |
| C25 | C26 | H262 | 112.2° | 109.5° |
| H251 | C25 | H252 | 98.3° | 109.6° |
| C27 | C26 | H261 | 112.2° | 109.5° |
| C27 | C26 | H262 | 112.1° | 109.4° |
| C26 | C27 | C28 | 110.2° | 109.4° |
| C26 | C27 | H271 | 111.9° | 109.5° |
| C26 | C27 | H272 | 111.9° | 109.4° |
| H261 | C26 | H262 | 98.3° | 109.5° |
| C28 | C27 | H271 | 111.9° | 109.5° |
| C28 | C27 | H272 | 111.9° | 109.5° |
| C27 | C28 | C29 | 111.7° | 109.4° |
| C27 | C28 | H281 | 111.4° | 109.5° |
| C27 | C28 | H282 | 111.4° | 109.5° |
| H271 | C27 | H272 | 98.5° | 109.5° |
| C29 | C28 | H281 | 111.4° | 109.5° |
| C29 | C28 | H282 | 111.4° | 109.4° |
| C28 | C29 | C30 | 112.0° | 109.4° |
| C28 | C29 | H291 | 111.3° | 109.5° |
| C28 | C29 | H292 | 111.3° | 109.4° |
| H281 | C28 | H282 | 98.9° | 109.5° |
| C30 | C29 | H291 | 111.3° | 109.5° |
| C30 | C29 | H292 | 111.2° | 109.5° |
| C29 | C30 | C31 | 112.0° | 109.4° |
| C29 | C30 | H301 | 111.3° | 109.5° |
| C29 | C30 | H302 | 111.3° | 109.5° |
| H291 | C29 | H292 | 99.1° | 109.5° |
| C31 | C30 | H301 | 111.3° | 109.5° |
| C31 | C30 | H302 | 111.3° | 109.4° |
| C30 | C31 | C32 | 109.6° | 109.4° |
| C30 | C31 | H311 | 112.1° | 109.5° |
| C30 | C31 | H312 | 112.1° | 109.4° |
| H301 | C30 | H302 | 99.0° | 109.5° |
| C32 | C31 | H311 | 112.1° | 109.5° |
| C32 | C31 | H312 | 112.2° | 109.5° |
| C31 | C32 | C33 | 112.8° | 109.4° |
| C31 | C32 | H321 | 111.0° | 109.5° |
| C31 | C32 | H322 | 111.0° | 109.5° |
| H311 | C31 | H312 | 98.3° | 109.4° |
| C33 | C32 | H321 | 111.0° | 109.5° |
| C33 | C32 | H322 | 111.0° | 109.4° |
| C32 | C33 | C34 | 115.6° | 109.4° |
| C32 | C33 | H331 | 109.9° | 109.5° |
| C32 | C33 | H332 | 110.0° | 109.4° |
| H321 | C32 | H322 | 99.3° | 109.5° |
| C34 | C33 | H331 | 109.9° | 109.5° |
| C34 | C33 | H332 | 109.9° | 109.5° |
| C33 | C34 | H341 | 115.7° | 109.5° |
| C33 | C34 | H342 | 110.0° | 109.5° |
| C33 | C34 | H343 | 110.0° | 109.5° |
| H331 | C33 | H332 | 100.3° | 109.5° |
| H341 | C34 | H342 | 110.0° | 109.5° |
| H341 | C34 | H343 | 109.9° | 109.5° |
| H342 | C34 | H343 | 100.2° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O11 | P | O12 | O13 | 114.9° | 120.0° |
| O11 | P | O12 | O14 | 115.7° | 120.0° |
| O11 | P | O13 | O14 | 124.0° | 120.0° |
| P | O11 | C03 | C02 | 153.4° | 180.0° |
| P | O11 | C03 | H031 | 81.3° | 60.0° |
| P | O11 | C03 | H032 | 28.2° | 60.0° |
| O11 | P | O12 | C04 | 97.5° | 175.0° |
| O11 | P | O13 | H13 | 179.9° | 60.0° |
| O12 | P | O13 | O14 | 125.5° | 120.0° |
| O12 | P | O11 | C03 | 95.5° | 175.0° |
| P | O12 | C04 | C05 | 119.7° | 180.0° |
| P | O12 | C04 | H041 | 5.6° | 60.0° |
| P | O12 | C04 | H042 | 115.0° | 60.0° |
| O12 | P | O13 | H13 | 69.5° | 60.0° |
| O13 | P | O11 | C03 | 149.6° | 65.0° |
| O13 | P | O12 | C04 | 147.5° | 65.0° |
| O14 | P | O11 | C03 | 20.9° | 55.0° |
| O14 | P | O12 | C04 | 18.1° | 55.0° |
| O14 | P | O13 | H13 | 56.0° | 180.0° |
| C05 | N | C06 | C07 | 118.2° | 120.0° |
| C05 | N | C06 | C08 | 126.4° | 120.0° |
| C05 | N | C07 | C08 | 118.6° | 120.0° |
| N | C05 | C04 | H051 | 125.2° | 120.0° |
| N | C05 | C04 | H052 | 125.3° | 120.0° |
| N | C05 | C04 | O12 | 84.6° | 67.9° |
| N | C05 | C04 | H041 | 40.6° | 52.1° |
| N | C05 | C04 | H042 | 150.1° | 172.1° |
| N | C05 | H051 | H052 | 116.8° | 120.0° |
| C05 | N | C06 | H061 | 180.0° | 60.0° |
| C05 | N | C06 | H062 | 54.7° | 180.0° |
| C05 | N | C06 | H063 | 54.7° | 60.0° |
| C05 | N | C07 | H071 | 180.0° | 60.0° |
| C05 | N | C07 | H072 | 54.7° | 180.0° |
| C05 | N | C07 | H073 | 54.8° | 60.0° |
| C05 | N | C08 | H081 | 180.0° | 70.1° |
| C05 | N | C08 | H082 | 54.8° | 170.0° |
| C05 | N | C08 | H083 | 54.8° | 50.0° |
| C06 | N | C07 | C08 | 119.1° | 120.0° |
| C06 | N | C05 | C04 | 35.0° | 61.2° |
| C06 | N | C05 | H051 | 90.3° | 58.8° |
| C06 | N | C05 | H052 | 160.2° | 178.8° |
| N | C06 | H061 | H062 | 125.3° | 120.0° |
| N | C06 | H061 | H063 | 125.3° | 120.0° |
| N | C06 | H062 | H063 | 116.4° | 120.0° |
| C06 | N | C07 | H071 | 57.7° | 180.0° |
| C06 | N | C07 | H072 | 177.0° | 60.0° |
| C06 | N | C07 | H073 | 67.5° | 60.0° |
| C06 | N | C08 | H081 | 51.5° | 49.9° |
| C06 | N | C08 | H082 | 73.7° | 70.0° |
| C06 | N | C08 | H083 | 176.8° | 169.9° |
| C07 | N | C05 | C04 | 151.5° | 178.8° |
| C07 | N | C05 | H051 | 26.2° | 61.2° |
| C07 | N | C05 | H052 | 83.3° | 58.8° |
| C07 | N | C06 | H061 | 61.8° | 60.0° |
| C07 | N | C06 | H062 | 63.5° | 60.0° |
| C07 | N | C06 | H063 | 173.0° | 180.0° |
| N | C07 | H071 | H072 | 125.3° | 120.0° |
| N | C07 | H071 | H073 | 125.2° | 120.0° |
| N | C07 | H072 | H073 | 118.7° | 120.0° |
| C07 | N | C08 | H081 | 62.9° | 169.9° |
| C07 | N | C08 | H082 | 171.9° | 50.0° |
| C07 | N | C08 | H083 | 62.3° | 70.1° |
| C08 | N | C05 | C04 | 92.4° | 58.8° |
| C08 | N | C05 | H051 | 142.4° | 178.8° |
| C08 | N | C05 | H052 | 32.9° | 61.2° |
| C08 | N | C06 | H061 | 53.5° | 180.0° |
| C08 | N | C06 | H062 | 178.8° | 60.0° |
| C08 | N | C06 | H063 | 71.7° | 60.0° |
| C08 | N | C07 | H071 | 61.4° | 60.0° |
| C08 | N | C07 | H072 | 63.9° | 60.0° |
| C08 | N | C07 | H073 | 173.4° | 180.0° |
| N | C08 | H081 | H082 | 125.2° | 120.0° |
| N | C08 | H081 | H083 | 125.3° | 120.0° |
| N | C08 | H082 | H083 | 117.8° | 120.0° |
| C02 | C01 | O03 | H011 | 125.2° | 120.0° |
| C02 | C01 | O03 | H012 | 125.3° | 120.0° |
| C02 | C01 | H011 | H012 | 117.4° | 120.0° |
| C01 | C02 | C03 | O01 | 130.0° | 120.0° |
| C01 | C02 | C03 | H02 | 114.3° | 120.0° |
| C01 | C02 | O01 | H02 | 114.5° | 120.0° |
| C01 | C02 | C03 | O11 | 32.5° | 55.0° |
| C01 | C02 | C03 | H031 | 157.8° | 65.0° |
| C01 | C02 | C03 | H032 | 92.8° | 175.0° |
| C01 | C02 | O01 | C1 | 78.9° | 150.0° |
| C02 | C01 | O03 | C19 | 109.3° | 180.0° |
| O03 | C01 | H011 | H012 | 117.4° | 120.0° |
| O03 | C01 | C02 | C03 | 126.9° | 55.0° |
| O03 | C01 | C02 | O01 | 103.3° | 65.0° |
| O03 | C01 | C02 | H02 | 12.3° | 175.0° |
| C01 | O03 | C19 | O04 | 60.2° | 0.0° |
| C01 | O03 | C19 | C20 | 119.6° | 180.0° |
| H011 | C01 | C02 | C03 | 1.6° | 65.0° |
| H011 | C01 | C02 | O01 | 131.4° | 175.0° |
| H011 | C01 | C02 | H02 | 113.0° | 55.0° |
| H011 | C01 | O03 | C19 | 125.4° | 60.0° |
| H012 | C01 | C02 | C03 | 107.8° | 175.0° |
| H012 | C01 | C02 | O01 | 21.9° | 55.0° |
| H012 | C01 | C02 | H02 | 137.6° | 65.0° |
| H012 | C01 | O03 | C19 | 15.9° | 60.0° |
| C03 | C02 | O01 | H02 | 114.9° | 120.0° |
| C02 | C03 | O11 | H031 | 125.3° | 120.0° |
| C02 | C03 | O11 | H032 | 125.2° | 120.0° |
| C02 | C03 | H031 | H032 | 117.5° | 120.0° |
| C03 | C02 | O01 | C1 | 51.6° | 90.0° |
| O01 | C02 | C03 | O11 | 162.5° | 65.0° |
| O01 | C02 | C03 | H031 | 72.2° | 175.0° |
| O01 | C02 | C03 | H032 | 37.2° | 55.0° |
| C02 | O01 | C1 | O02 | 67.3° | 0.1° |
| C02 | O01 | C1 | C2 | 126.1° | 180.0° |
| H02 | C02 | C03 | O11 | 81.8° | 175.0° |
| H02 | C02 | C03 | H031 | 43.5° | 55.0° |
| H02 | C02 | C03 | H032 | 152.9° | 65.0° |
| H02 | C02 | O01 | C1 | 166.5° | 30.0° |
| O11 | C03 | H031 | H032 | 117.5° | 120.0° |
| C05 | C04 | O12 | H041 | 125.3° | 120.0° |
| C05 | C04 | O12 | H042 | 125.3° | 120.0° |
| C05 | C04 | H041 | H042 | 117.0° | 120.0° |
| C04 | C05 | H051 | H052 | 116.8° | 120.0° |
| O12 | C04 | H041 | H042 | 116.9° | 120.0° |
| O12 | C04 | C05 | H051 | 150.2° | 172.1° |
| O12 | C04 | C05 | H052 | 40.7° | 52.0° |
| H041 | C04 | C05 | H051 | 84.6° | 67.9° |
| H041 | C04 | C05 | H052 | 165.9° | 172.0° |
| H042 | C04 | C05 | H051 | 24.9° | 52.1° |
| H042 | C04 | C05 | H052 | 84.6° | 67.9° |
| H061 | C06 | H062 | H063 | 116.2° | 120.1° |
| H071 | C07 | H072 | H073 | 118.6° | 120.0° |
| H081 | C08 | H082 | H083 | 117.8° | 120.0° |
| O01 | C1 | O02 | C2 | 164.6° | 179.9° |
| O01 | C1 | C2 | C3 | 108.0° | 180.0° |
| O01 | C1 | C2 | H21 | 126.7° | 60.0° |
| O01 | C1 | C2 | H22 | 17.2° | 59.9° |
| O02 | C1 | C2 | C3 | 85.4° | 0.1° |
| O02 | C1 | C2 | H21 | 39.9° | 120.0° |
| O02 | C1 | C2 | H22 | 149.4° | 120.0° |
| O03 | C19 | O04 | C20 | 179.8° | 180.0° |
| O03 | C19 | C20 | C21 | 80.5° | 180.0° |
| O03 | C19 | C20 | H201 | 44.7° | 60.0° |
| O03 | C19 | C20 | H202 | 154.2° | 60.0° |
| O04 | C19 | C20 | C21 | 99.3° | 0.0° |
| O04 | C19 | C20 | H201 | 135.5° | 120.0° |
| O04 | C19 | C20 | H202 | 25.9° | 120.0° |
| C1 | C2 | C3 | H21 | 125.3° | 120.0° |
| C1 | C2 | C3 | H22 | 125.3° | 120.1° |
| C1 | C2 | H21 | H22 | 114.9° | 120.0° |
| C1 | C2 | C3 | C4 | 137.4° | 180.0° |
| C1 | C2 | C3 | H31 | 12.0° | 60.0° |
| C1 | C2 | C3 | H32 | 97.4° | 60.0° |
| C3 | C2 | H21 | H22 | 114.9° | 120.0° |
| C2 | C3 | C4 | H31 | 125.3° | 120.0° |
| C2 | C3 | C4 | H32 | 125.3° | 120.0° |
| C2 | C3 | H31 | H32 | 116.0° | 120.0° |
| C2 | C3 | C4 | C5 | 114.8° | 180.0° |
| C2 | C3 | C4 | H41 | 10.4° | 60.0° |
| C2 | C3 | C4 | H42 | 119.9° | 60.0° |
| H21 | C2 | C3 | C4 | 97.4° | 60.0° |
| H21 | C2 | C3 | H31 | 137.3° | 180.0° |
| H21 | C2 | C3 | H32 | 27.9° | 60.0° |
| H22 | C2 | C3 | C4 | 12.1° | 60.0° |
| H22 | C2 | C3 | H31 | 113.2° | 60.0° |
| H22 | C2 | C3 | H32 | 137.3° | 180.0° |
| C4 | C3 | H31 | H32 | 116.0° | 120.0° |
| C3 | C4 | C5 | H41 | 125.2° | 120.0° |
| C3 | C4 | C5 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 115.2° | 120.0° |
| C3 | C4 | C5 | C6 | 132.0° | 180.0° |
| C3 | C4 | C5 | H51 | 102.7° | 60.0° |
| C3 | C4 | C5 | H52 | 6.7° | 60.0° |
| H31 | C3 | C4 | C5 | 119.9° | 60.0° |
| H31 | C3 | C4 | H41 | 114.9° | 180.0° |
| H31 | C3 | C4 | H42 | 5.4° | 60.0° |
| H32 | C3 | C4 | C5 | 10.4° | 60.0° |
| H32 | C3 | C4 | H41 | 135.7° | 60.0° |
| H32 | C3 | C4 | H42 | 114.8° | NaN° |
| C5 | C4 | H41 | H42 | 115.1° | 120.0° |
| C4 | C5 | C6 | H51 | 125.3° | 120.0° |
| C4 | C5 | C6 | H52 | 125.2° | 120.0° |
| C4 | C5 | H51 | H52 | 115.4° | 120.0° |
| C4 | C5 | C6 | C7 | 149.6° | 180.0° |
| C4 | C5 | C6 | H61 | 24.3° | 60.0° |
| C4 | C5 | C6 | H62 | 85.2° | 60.0° |
| H41 | C4 | C5 | C6 | 6.8° | 60.0° |
| H41 | C4 | C5 | H51 | 132.1° | NaN° |
| H41 | C4 | C5 | H52 | 118.5° | 60.0° |
| H42 | C4 | C5 | C6 | 102.8° | 60.0° |
| H42 | C4 | C5 | H51 | 22.5° | 60.0° |
| H42 | C4 | C5 | H52 | 132.0° | 180.0° |
| C6 | C5 | H51 | H52 | 115.4° | 120.0° |
| C5 | C6 | C7 | H61 | 125.3° | 120.0° |
| C5 | C6 | C7 | H62 | 125.3° | 120.0° |
| C5 | C6 | H61 | H62 | 116.3° | 120.0° |
| C5 | C6 | C7 | C8 | 175.6° | 180.0° |
| C5 | C6 | C7 | H71 | 59.2° | 60.0° |
| C5 | C6 | C7 | H72 | 50.3° | 60.0° |
| H51 | C5 | C6 | C7 | 85.1° | 60.0° |
| H51 | C5 | C6 | H61 | 149.6° | 180.0° |
| H51 | C5 | C6 | H62 | 40.1° | 60.0° |
| H52 | C5 | C6 | C7 | 24.3° | 60.0° |
| H52 | C5 | C6 | H61 | 100.9° | 60.0° |
| H52 | C5 | C6 | H62 | 149.6° | 180.0° |
| C7 | C6 | H61 | H62 | 116.2° | 120.0° |
| C6 | C7 | C8 | H71 | 125.3° | 120.0° |
| C6 | C7 | C8 | H72 | 125.3° | 120.0° |
| C6 | C7 | H71 | H72 | 115.2° | 120.0° |
| C6 | C7 | C8 | C9 | 160.9° | 180.0° |
| C6 | C7 | C8 | H81 | 35.7° | 60.0° |
| C6 | C7 | C8 | H82 | 73.9° | 60.0° |
| H61 | C6 | C7 | C8 | 50.3° | 60.0° |
| H61 | C6 | C7 | H71 | 175.5° | 180.0° |
| H61 | C6 | C7 | H72 | 75.0° | 60.0° |
| H62 | C6 | C7 | C8 | 59.2° | 60.0° |
| H62 | C6 | C7 | H71 | 66.1° | 60.0° |
| H62 | C6 | C7 | H72 | 175.6° | 180.0° |
| C8 | C7 | H71 | H72 | 115.1° | 120.0° |
| C7 | C8 | C9 | H81 | 125.3° | 120.0° |
| C7 | C8 | C9 | H82 | 125.3° | 120.0° |
| C7 | C8 | H81 | H82 | 116.6° | 120.0° |
| C7 | C8 | C9 | C10 | 166.2° | 127.5° |
| C7 | C8 | C9 | H9 | 13.8° | 52.5° |
| H71 | C7 | C8 | C9 | 73.8° | 60.0° |
| H71 | C7 | C8 | H81 | 160.9° | 180.0° |
| H71 | C7 | C8 | H82 | 51.4° | 60.0° |
| H72 | C7 | C8 | C9 | 35.6° | 60.0° |
| H72 | C7 | C8 | H81 | 89.6° | 60.0° |
| H72 | C7 | C8 | H82 | 160.8° | 180.0° |
| C9 | C8 | H81 | H82 | 116.5° | 120.0° |
| C8 | C9 | C10 | H9 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 0.8° | 8.6° |
| C8 | C9 | C10 | H10 | 179.2° | 171.4° |
| H81 | C8 | C9 | C10 | 68.5° | 7.5° |
| H81 | C8 | C9 | H9 | 111.5° | 172.5° |
| H82 | C8 | C9 | C10 | 40.9° | 112.5° |
| H82 | C8 | C9 | H9 | 139.1° | 67.5° |
| C9 | C10 | C11 | H10 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 156.5° | 126.6° |
| C9 | C10 | C11 | H111 | 31.3° | 113.4° |
| C9 | C10 | C11 | H112 | 78.2° | 6.6° |
| H9 | C9 | C10 | C11 | 179.2° | 171.4° |
| H9 | C9 | C10 | H10 | 0.8° | 8.7° |
| C10 | C11 | C12 | H111 | 125.3° | 120.0° |
| C10 | C11 | C12 | H112 | 125.2° | 120.0° |
| C10 | C11 | H111 | H112 | 116.4° | 119.9° |
| C10 | C11 | C12 | C13 | 135.0° | 125.1° |
| C10 | C11 | C12 | H12 | 44.9° | 55.0° |
| H10 | C10 | C11 | C12 | 23.4° | 53.5° |
| H10 | C10 | C11 | H111 | 148.7° | 66.5° |
| H10 | C10 | C11 | H112 | 101.8° | 173.5° |
| C12 | C11 | H111 | H112 | 116.4° | 120.1° |
| C11 | C12 | C13 | H12 | 179.9° | 180.0° |
| C11 | C12 | C13 | C14 | 129.5° | 180.0° |
| C11 | C12 | C13 | H1 | 50.4° | 0.0° |
| H111 | C11 | C12 | C13 | 99.7° | 5.0° |
| H111 | C11 | C12 | H12 | 80.4° | 175.0° |
| H112 | C11 | C12 | C13 | 9.8° | 115.0° |
| H112 | C11 | C12 | H12 | 170.1° | 65.0° |
| C12 | C13 | C14 | H1 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 156.5° | 125.0° |
| C12 | C13 | C14 | H141 | 78.2° | 115.1° |
| C12 | C13 | C14 | H142 | 31.2° | 5.0° |
| H12 | C12 | C13 | C14 | 50.4° | 0.0° |
| H12 | C12 | C13 | H1 | 129.6° | 180.0° |
| C13 | C14 | C15 | H141 | 125.3° | 119.9° |
| C13 | C14 | C15 | H142 | 125.3° | 120.0° |
| C13 | C14 | H141 | H142 | 111.6° | 120.1° |
| C13 | C14 | C15 | C16 | 0.2° | 180.0° |
| C13 | C14 | C15 | H151 | 125.1° | 60.1° |
| C13 | C14 | C15 | H152 | 125.6° | 60.0° |
| H1 | C13 | C14 | C15 | 23.6° | 55.0° |
| H1 | C13 | C14 | H141 | 101.7° | 65.0° |
| H1 | C13 | C14 | H142 | 148.8° | 175.0° |
| C15 | C14 | H141 | H142 | 111.6° | 120.0° |
| C14 | C15 | C16 | H151 | 125.3° | 120.0° |
| C14 | C15 | C16 | H152 | 125.3° | 120.0° |
| C14 | C15 | H151 | H152 | 111.5° | 120.0° |
| C14 | C15 | C16 | C17 | 145.8° | 180.0° |
| C14 | C15 | C16 | H161 | 89.0° | 60.0° |
| C14 | C15 | C16 | H162 | 20.5° | 60.0° |
| H141 | C14 | C15 | C16 | 125.5° | 60.0° |
| H141 | C14 | C15 | H151 | 0.3° | 180.0° |
| H141 | C14 | C15 | H152 | 109.1° | 60.0° |
| H142 | C14 | C15 | C16 | 125.0° | 60.0° |
| H142 | C14 | C15 | H151 | 109.7° | 60.0° |
| H142 | C14 | C15 | H152 | 0.3° | 180.0° |
| C16 | C15 | H151 | H152 | 111.5° | 120.1° |
| C15 | C16 | C17 | H161 | 125.2° | 120.0° |
| C15 | C16 | C17 | H162 | 125.3° | 120.0° |
| C15 | C16 | H161 | H162 | 115.5° | 120.0° |
| C15 | C16 | C17 | C18 | 91.5° | 180.0° |
| C15 | C16 | C17 | H171 | 143.2° | 60.1° |
| C15 | C16 | C17 | H172 | 33.8° | 60.0° |
| H151 | C15 | C16 | C17 | 20.5° | 60.0° |
| H151 | C15 | C16 | H161 | 145.7° | 180.0° |
| H151 | C15 | C16 | H162 | 104.8° | 60.0° |
| H152 | C15 | C16 | C17 | 88.9° | 60.0° |
| H152 | C15 | C16 | H161 | 36.3° | 59.9° |
| H152 | C15 | C16 | H162 | 145.8° | 180.0° |
| C17 | C16 | H161 | H162 | 115.5° | 120.0° |
| C16 | C17 | C18 | H171 | 125.3° | 120.0° |
| C16 | C17 | C18 | H172 | 125.3° | 120.0° |
| C16 | C17 | H171 | H172 | 113.2° | 120.1° |
| C16 | C17 | C18 | H181 | 180.0° | 60.0° |
| C16 | C17 | C18 | H182 | 54.8° | 60.0° |
| C16 | C17 | C18 | H183 | 54.7° | 180.0° |
| H161 | C16 | C17 | C18 | 33.8° | 60.0° |
| H161 | C16 | C17 | H171 | 91.5° | 180.0° |
| H161 | C16 | C17 | H172 | 159.0° | 60.0° |
| H162 | C16 | C17 | C18 | 143.3° | 60.0° |
| H162 | C16 | C17 | H171 | 18.0° | 59.9° |
| H162 | C16 | C17 | H172 | 91.5° | 180.0° |
| C18 | C17 | H171 | H172 | 113.1° | 120.0° |
| C17 | C18 | H181 | H182 | 125.2° | 120.0° |
| C17 | C18 | H181 | H183 | 125.3° | 120.0° |
| C17 | C18 | H182 | H183 | 113.2° | 120.0° |
| H171 | C17 | C18 | H181 | 54.8° | 180.0° |
| H171 | C17 | C18 | H182 | 179.9° | 60.0° |
| H171 | C17 | C18 | H183 | 70.6° | 60.0° |
| H172 | C17 | C18 | H181 | 54.7° | 60.0° |
| H172 | C17 | C18 | H182 | 70.5° | 180.0° |
| H172 | C17 | C18 | H183 | 180.0° | 60.0° |
| H181 | C18 | H182 | H183 | 113.2° | 120.0° |
| C19 | C20 | C21 | H201 | 125.2° | 119.9° |
| C19 | C20 | C21 | H202 | 125.3° | 120.1° |
| C19 | C20 | H201 | H202 | 117.2° | 120.0° |
| C19 | C20 | C21 | C22 | 83.2° | 180.0° |
| C19 | C20 | C21 | H211 | 42.0° | 60.1° |
| C19 | C20 | C21 | H212 | 151.5° | 60.0° |
| C21 | C20 | H201 | H202 | 117.1° | 120.0° |
| C20 | C21 | C22 | H211 | 125.3° | 120.0° |
| C20 | C21 | C22 | H212 | 125.3° | 120.0° |
| C20 | C21 | H211 | H212 | 115.7° | 120.0° |
| C20 | C21 | C22 | C23 | 15.2° | 180.0° |
| C20 | C21 | C22 | H221 | 110.0° | 60.0° |
| C20 | C21 | C22 | H222 | 140.5° | 60.0° |
| H201 | C20 | C21 | C22 | 151.5° | 60.0° |
| H201 | C20 | C21 | H211 | 83.2° | 180.0° |
| H201 | C20 | C21 | H212 | 26.3° | 59.9° |
| H202 | C20 | C21 | C22 | 42.1° | 60.0° |
| H202 | C20 | C21 | H211 | 167.3° | 60.0° |
| H202 | C20 | C21 | H212 | 83.2° | 179.9° |
| C22 | C21 | H211 | H212 | 115.7° | 120.0° |
| C21 | C22 | C23 | H221 | 125.3° | 120.0° |
| C21 | C22 | C23 | H222 | 125.3° | 120.0° |
| C21 | C22 | H221 | H222 | 116.6° | 120.1° |
| C21 | C22 | C23 | C24 | 158.9° | 180.0° |
| C21 | C22 | C23 | H231 | 33.6° | 60.0° |
| C21 | C22 | C23 | H232 | 75.9° | 60.0° |
| H211 | C21 | C22 | C23 | 140.5° | 60.0° |
| H211 | C21 | C22 | H221 | 15.2° | 180.0° |
| H211 | C21 | C22 | H222 | 94.2° | 59.9° |
| H212 | C21 | C22 | C23 | 110.1° | 60.1° |
| H212 | C21 | C22 | H221 | 124.7° | 59.9° |
| H212 | C21 | C22 | H222 | 15.2° | 180.0° |
| C23 | C22 | H221 | H222 | 116.5° | 119.9° |
| C22 | C23 | C24 | H231 | 125.3° | 120.0° |
| C22 | C23 | C24 | H232 | 125.2° | 119.9° |
| C22 | C23 | H231 | H232 | 116.6° | 120.0° |
| C22 | C23 | C24 | C25 | 28.8° | 180.0° |
| C22 | C23 | C24 | H241 | 154.0° | 60.0° |
| C22 | C23 | C24 | H242 | 96.5° | 60.0° |
| H221 | C22 | C23 | C24 | 75.8° | 59.9° |
| H221 | C22 | C23 | H231 | 158.9° | 180.0° |
| H221 | C22 | C23 | H232 | 49.4° | 60.0° |
| H222 | C22 | C23 | C24 | 33.6° | 60.0° |
| H222 | C22 | C23 | H231 | 91.7° | 60.0° |
| H222 | C22 | C23 | H232 | 158.8° | 179.9° |
| C24 | C23 | H231 | H232 | 116.7° | 120.0° |
| C23 | C24 | C25 | H241 | 125.3° | 120.1° |
| C23 | C24 | C25 | H242 | 125.3° | 119.9° |
| C23 | C24 | H241 | H242 | 117.4° | 120.0° |
| C23 | C24 | C25 | C26 | 147.0° | 180.0° |
| C23 | C24 | C25 | H251 | 87.7° | 60.0° |
| C23 | C24 | C25 | H252 | 21.7° | 60.1° |
| H231 | C23 | C24 | C25 | 96.5° | 60.0° |
| H231 | C23 | C24 | H241 | 28.8° | 180.0° |
| H231 | C23 | C24 | H242 | 138.3° | 59.9° |
| H232 | C23 | C24 | C25 | 154.0° | 60.1° |
| H232 | C23 | C24 | H241 | 80.8° | 59.9° |
| H232 | C23 | C24 | H242 | 28.7° | 180.0° |
| C25 | C24 | H241 | H242 | 117.3° | 120.0° |
| C24 | C25 | C26 | H251 | 125.3° | 120.0° |
| C24 | C25 | C26 | H252 | 125.3° | 119.9° |
| C24 | C25 | H251 | H252 | 118.0° | 120.0° |
| C24 | C25 | C26 | C27 | 91.2° | 180.0° |
| C24 | C25 | C26 | H261 | 143.6° | 59.9° |
| C24 | C25 | C26 | H262 | 34.1° | 60.1° |
| H241 | C24 | C25 | C26 | 21.7° | 59.9° |
| H241 | C24 | C25 | H251 | 147.0° | 180.0° |
| H241 | C24 | C25 | H252 | 103.6° | 60.0° |
| H242 | C24 | C25 | C26 | 87.7° | 60.1° |
| H242 | C24 | C25 | H251 | 37.5° | 60.0° |
| H242 | C24 | C25 | H252 | 147.0° | 180.0° |
| C26 | C25 | H251 | H252 | 118.0° | 120.0° |
| C25 | C26 | C27 | H261 | 125.2° | 120.1° |
| C25 | C26 | C27 | H262 | 125.3° | 120.0° |
| C25 | C26 | H261 | H262 | 118.1° | 120.0° |
| C25 | C26 | C27 | C28 | 169.6° | 180.0° |
| C25 | C26 | C27 | H271 | 65.1° | 59.9° |
| C25 | C26 | C27 | H272 | 44.4° | 60.0° |
| H251 | C25 | C26 | C27 | 34.1° | 60.0° |
| H251 | C25 | C26 | H261 | 91.1° | 180.0° |
| H251 | C25 | C26 | H262 | 159.3° | 59.9° |
| H252 | C25 | C26 | C27 | 143.6° | 60.1° |
| H252 | C25 | C26 | H261 | 18.3° | 59.9° |
| H252 | C25 | C26 | H262 | 91.2° | 180.0° |
| C27 | C26 | H261 | H262 | 118.1° | 120.0° |
| C26 | C27 | C28 | H271 | 125.3° | 120.0° |
| C26 | C27 | C28 | H272 | 125.3° | 119.9° |
| C26 | C27 | H271 | H272 | 117.9° | 120.0° |
| C26 | C27 | C28 | C29 | 77.8° | 180.0° |
| C26 | C27 | C28 | H281 | 47.5° | 60.0° |
| C26 | C27 | C28 | H282 | 157.0° | 60.0° |
| H261 | C26 | C27 | C28 | 44.4° | 60.0° |
| H261 | C26 | C27 | H271 | 169.7° | 180.0° |
| H261 | C26 | C27 | H272 | 80.9° | 60.0° |
| H262 | C26 | C27 | C28 | 65.1° | 60.0° |
| H262 | C26 | C27 | H271 | 60.2° | 60.0° |
| H262 | C26 | C27 | H272 | 169.6° | 180.0° |
| C28 | C27 | H271 | H272 | 117.8° | 120.1° |
| C27 | C28 | C29 | H281 | 125.3° | 120.0° |
| C27 | C28 | C29 | H282 | 125.3° | 120.0° |
| C27 | C28 | H281 | H282 | 117.3° | 120.0° |
| C27 | C28 | C29 | C30 | 136.2° | 180.0° |
| C27 | C28 | C29 | H291 | 11.0° | 60.0° |
| C27 | C28 | C29 | H292 | 98.5° | 60.0° |
| H271 | C27 | C28 | C29 | 156.9° | 60.0° |
| H271 | C27 | C28 | H281 | 77.8° | 180.0° |
| H271 | C27 | C28 | H282 | 31.7° | 60.0° |
| H272 | C27 | C28 | C29 | 47.5° | 60.1° |
| H272 | C27 | C28 | H281 | 172.8° | 59.9° |
| H272 | C27 | C28 | H282 | 77.8° | 180.0° |
| C29 | C28 | H281 | H282 | 117.3° | 120.0° |
| C28 | C29 | C30 | H291 | 125.3° | 120.0° |
| C28 | C29 | C30 | H292 | 125.3° | 119.9° |
| C28 | C29 | H291 | H292 | 117.2° | 120.0° |
| C28 | C29 | C30 | C31 | 68.9° | 180.0° |
| C28 | C29 | C30 | H301 | 56.4° | 60.0° |
| C28 | C29 | C30 | H302 | 165.8° | 60.0° |
| H281 | C28 | C29 | C30 | 98.5° | 60.0° |
| H281 | C28 | C29 | H291 | 136.3° | 180.0° |
| H281 | C28 | C29 | H292 | 26.7° | 60.0° |
| H282 | C28 | C29 | C30 | 11.0° | 60.0° |
| H282 | C28 | C29 | H291 | 114.3° | 60.0° |
| H282 | C28 | C29 | H292 | 136.2° | 180.0° |
| C30 | C29 | H291 | H292 | 117.1° | 120.1° |
| C29 | C30 | C31 | H301 | 125.3° | 120.0° |
| C29 | C30 | C31 | H302 | 125.3° | 120.0° |
| C29 | C30 | H301 | H302 | 117.2° | 120.0° |
| C29 | C30 | C31 | C32 | 110.6° | 180.0° |
| C29 | C30 | C31 | H311 | 124.1° | 60.0° |
| C29 | C30 | C31 | H312 | 14.7° | 60.0° |
| H291 | C29 | C30 | C31 | 165.9° | 60.0° |
| H291 | C29 | C30 | H301 | 68.9° | NaN° |
| H291 | C29 | C30 | H302 | 40.6° | 60.0° |
| H292 | C29 | C30 | C31 | 56.4° | 60.1° |
| H292 | C29 | C30 | H301 | 178.4° | 59.9° |
| H292 | C29 | C30 | H302 | 68.9° | 180.0° |
| C31 | C30 | H301 | H302 | 117.1° | 120.0° |
| C30 | C31 | C32 | H311 | 125.2° | 120.0° |
| C30 | C31 | C32 | H312 | 125.3° | 120.0° |
| C30 | C31 | H311 | H312 | 118.1° | 119.9° |
| C30 | C31 | C32 | C33 | 178.8° | 180.0° |
| C30 | C31 | C32 | H321 | 55.9° | 60.0° |
| C30 | C31 | C32 | H322 | 53.6° | 60.0° |
| H301 | C30 | C31 | C32 | 14.7° | 60.0° |
| H301 | C30 | C31 | H311 | 110.6° | 180.0° |
| H301 | C30 | C31 | H312 | 140.0° | 60.0° |
| H302 | C30 | C31 | C32 | 124.0° | 60.0° |
| H302 | C30 | C31 | H311 | 1.2° | 60.0° |
| H302 | C30 | C31 | H312 | 110.7° | 180.0° |
| C32 | C31 | H311 | H312 | 118.1° | 120.1° |
| C31 | C32 | C33 | H321 | 125.3° | 120.0° |
| C31 | C32 | C33 | H322 | 125.3° | 120.0° |
| C31 | C32 | H321 | H322 | 116.9° | 120.0° |
| C31 | C32 | C33 | C34 | 149.0° | 180.0° |
| C31 | C32 | C33 | H331 | 23.8° | 60.0° |
| C31 | C32 | C33 | H332 | 85.8° | 60.0° |
| H311 | C31 | C32 | C33 | 53.6° | 60.0° |
| H311 | C31 | C32 | H321 | 178.9° | 180.0° |
| H311 | C31 | C32 | H322 | 71.7° | 60.0° |
| H312 | C31 | C32 | C33 | 55.9° | 60.0° |
| H312 | C31 | C32 | H321 | 69.4° | 60.0° |
| H312 | C31 | C32 | H322 | 178.9° | 180.0° |
| C33 | C32 | H321 | H322 | 116.8° | 120.0° |
| C32 | C33 | C34 | H331 | 125.2° | 120.0° |
| C32 | C33 | C34 | H332 | 125.2° | 120.0° |
| C32 | C33 | H331 | H332 | 115.8° | 120.0° |
| C32 | C33 | C34 | H341 | 180.0° | 60.0° |
| C32 | C33 | C34 | H342 | 54.7° | 180.0° |
| C32 | C33 | C34 | H343 | 54.7° | 60.0° |
| H321 | C32 | C33 | C34 | 85.7° | 60.0° |
| H321 | C32 | C33 | H331 | 149.1° | 180.0° |
| H321 | C32 | C33 | H332 | 39.5° | 60.0° |
| H322 | C32 | C33 | C34 | 23.7° | 60.0° |
| H322 | C32 | C33 | H331 | 101.5° | 60.0° |
| H322 | C32 | C33 | H332 | 148.9° | 180.0° |
| C34 | C33 | H331 | H332 | 115.8° | 120.0° |
| C33 | C34 | H341 | H342 | 125.3° | 120.0° |
| C33 | C34 | H341 | H343 | 125.3° | 120.0° |
| C33 | C34 | H342 | H343 | 115.8° | 120.0° |
| H331 | C33 | C34 | H341 | 54.8° | 180.0° |
| H331 | C33 | C34 | H342 | 179.9° | 60.0° |
| H331 | C33 | C34 | H343 | 70.5° | 60.0° |
| H332 | C33 | C34 | H341 | 54.8° | 60.0° |
| H332 | C33 | C34 | H342 | 70.5° | 60.0° |
| H332 | C33 | C34 | H343 | 180.0° | 180.0° |
| H341 | C34 | H342 | H343 | 115.7° | 120.0° |
