LPE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.42Å | 1.41Å | |
| C1 | C2 | sing | 1.52Å | 1.51Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.10Å | 1.10Å | |
| O1 | C11 | sing | 1.42Å | 1.41Å | |
| C2 | O2H | sing | 1.43Å | 1.43Å | |
| C2 | C3 | sing | 1.52Å | 1.50Å | |
| C2 | H21 | sing | 1.10Å | 1.10Å | |
| O2H | HO21 | sing | 0.97Å | 0.95Å | |
| C3 | O3 | sing | 1.42Å | 1.41Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H32 | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.52Å | 1.51Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.10Å | 1.10Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C12 | H121 | sing | 1.10Å | 1.10Å | |
| C12 | H122 | sing | 1.10Å | 1.10Å | |
| O3 | P | sing | 1.62Å | 1.62Å | |
| P | O31 | doub | 1.50Å | 1.52Å | |
| P | O32 | sing | 1.62Å | 1.51Å | |
| P | O33 | sing | 1.62Å | 1.60Å | |
| O32 | HO31 | sing | 0.98Å | 0.95Å | |
| O33 | C31 | sing | 1.42Å | 1.43Å | |
| C31 | C32 | sing | 1.52Å | 1.53Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | N | sing | 1.49Å | 1.48Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| N | C1N | sing | 1.53Å | 1.48Å | |
| N | C2N | sing | 1.53Å | 1.48Å | |
| N | C3N | sing | 1.53Å | 1.48Å | |
| C1N | H1N1 | sing | 1.09Å | 1.10Å | |
| C1N | H1N2 | sing | 1.09Å | 1.10Å | |
| C1N | H1N3 | sing | 1.09Å | 1.10Å | |
| C2N | H2N1 | sing | 1.09Å | 1.10Å | |
| C2N | H2N2 | sing | 1.09Å | 1.10Å | |
| C2N | H2N3 | sing | 1.09Å | 1.10Å | |
| C3N | H3N1 | sing | 1.09Å | 1.10Å | |
| C3N | H3N2 | sing | 1.09Å | 1.10Å | |
| C3N | H3N3 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | H131 | sing | 1.10Å | 1.10Å | |
| C13 | H132 | sing | 1.10Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C14 | H141 | sing | 1.10Å | 1.10Å | |
| C14 | H142 | sing | 1.10Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.55Å | |
| C15 | H151 | sing | 1.10Å | 1.10Å | |
| C15 | H152 | sing | 1.10Å | 1.10Å | |
| C16 | C17 | sing | 1.53Å | 58.95Å | |
| C16 | H161 | sing | 1.10Å | 1.10Å | |
| C16 | H162 | sing | 1.10Å | 1.10Å | |
| C17 | C18 | sing | 1.53Å | 0.00Å | |
| C17 | H171 | sing | 1.10Å | 0.00Å | |
| C17 | H172 | sing | 1.10Å | 0.00Å | |
| C18 | C19 | sing | 1.53Å | 0.00Å | |
| C18 | H181 | sing | 1.10Å | 0.00Å | |
| C18 | H182 | sing | 1.10Å | 0.00Å | |
| C19 | C20 | sing | 1.53Å | 0.00Å | |
| C19 | H191 | sing | 1.10Å | 0.00Å | |
| C19 | H192 | sing | 1.10Å | 0.00Å | |
| C20 | C21 | sing | 1.53Å | 0.00Å | |
| C20 | H201 | sing | 1.10Å | 0.00Å | |
| C20 | H202 | sing | 1.10Å | 0.00Å | |
| C21 | C22 | sing | 1.53Å | 0.00Å | |
| C21 | H211 | sing | 1.10Å | 0.00Å | |
| C21 | H212 | sing | 1.10Å | 0.00Å | |
| C22 | C23 | sing | 1.53Å | 0.00Å | |
| C22 | H221 | sing | 1.10Å | 0.00Å | |
| C22 | H222 | sing | 1.10Å | 0.00Å | |
| C23 | C24 | sing | 1.53Å | 0.00Å | |
| C23 | H231 | sing | 1.10Å | 0.00Å | |
| C23 | H232 | sing | 1.10Å | 0.00Å | |
| C24 | C25 | sing | 1.53Å | 0.00Å | |
| C24 | H241 | sing | 1.10Å | 0.00Å | |
| C24 | H242 | sing | 1.10Å | 0.00Å | |
| C25 | C26 | sing | 1.53Å | 0.00Å | |
| C25 | H251 | sing | 1.10Å | 0.00Å | |
| C25 | H252 | sing | 1.10Å | 0.00Å | |
| C26 | C27 | sing | 1.53Å | 0.00Å | |
| C26 | H261 | sing | 1.10Å | 0.00Å | |
| C26 | H262 | sing | 1.10Å | 0.00Å | |
| C27 | C28 | sing | 1.52Å | 0.00Å | |
| C27 | H271 | sing | 1.10Å | 0.00Å | |
| C27 | H272 | sing | 1.09Å | 0.00Å | |
| C28 | H281 | sing | 1.09Å | 0.00Å | |
| C28 | H282 | sing | 1.09Å | 0.00Å | |
| C28 | H283 | sing | 1.10Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 109.7° | 109.0° |
| O1 | C1 | H11 | 109.4° | 107.8° |
| O1 | C1 | H12 | 109.4° | 108.0° |
| C1 | O1 | C11 | 111.8° | 111.6° |
| C2 | C1 | H11 | 109.4° | 111.3° |
| C2 | C1 | H12 | 109.4° | 111.1° |
| C1 | C2 | O2H | 108.0° | 108.0° |
| C1 | C2 | C3 | 110.1° | 111.5° |
| C1 | C2 | H21 | 110.0° | 110.7° |
| H11 | C1 | H12 | 109.6° | 109.5° |
| O1 | C11 | C12 | 110.6° | 110.0° |
| O1 | C11 | H111 | 109.1° | 108.9° |
| O1 | C11 | H112 | 108.9° | 108.2° |
| O2H | C2 | C3 | 109.5° | 108.7° |
| O2H | C2 | H21 | 110.6° | 106.7° |
| C2 | O2H | HO21 | 109.5° | 106.3° |
| C3 | C2 | H21 | 108.6° | 111.2° |
| C2 | C3 | O3 | 112.3° | 109.9° |
| C2 | C3 | H31 | 108.5° | 111.6° |
| C2 | C3 | H32 | 107.9° | 111.1° |
| O3 | C3 | H31 | 108.5° | 108.0° |
| O3 | C3 | H32 | 107.9° | 107.3° |
| C3 | O3 | P | 118.9° | 118.3° |
| H31 | C3 | H32 | 111.7° | 108.8° |
| C12 | C11 | H111 | 109.1° | 111.0° |
| C12 | C11 | H112 | 108.9° | 110.0° |
| C11 | C12 | C13 | 111.4° | 112.2° |
| C11 | C12 | H121 | 108.8° | 109.3° |
| C11 | C12 | H122 | 108.4° | 108.5° |
| H111 | C11 | H112 | 110.4° | 108.7° |
| C13 | C12 | H121 | 108.8° | 108.9° |
| C13 | C12 | H122 | 108.4° | 110.1° |
| C12 | C13 | C14 | 110.8° | 113.4° |
| C12 | C13 | H131 | 109.1° | 109.3° |
| C12 | C13 | H132 | 108.8° | 109.7° |
| H121 | C12 | H122 | 111.0° | 107.8° |
| O3 | P | O31 | 106.5° | 115.2° |
| O3 | P | O32 | 110.4° | 103.3° |
| O3 | P | O33 | 102.2° | 103.1° |
| O31 | P | O32 | 118.4° | 114.1° |
| O31 | P | O33 | 106.8° | 115.1° |
| O32 | P | O33 | 111.2° | 104.5° |
| P | O32 | HO31 | 109.5° | 118.8° |
| P | O33 | C31 | 118.4° | 120.1° |
| O33 | C31 | C32 | 109.8° | 109.5° |
| O33 | C31 | H311 | 109.4° | 107.9° |
| O33 | C31 | H312 | 109.3° | 109.0° |
| C32 | C31 | H311 | 109.4° | 109.8° |
| C32 | C31 | H312 | 109.3° | 111.7° |
| C31 | C32 | N | 109.5° | 109.2° |
| C31 | C32 | H321 | 109.5° | 112.1° |
| C31 | C32 | H322 | 109.5° | 111.7° |
| H311 | C31 | H312 | 109.7° | 108.8° |
| N | C32 | H321 | 109.4° | 106.4° |
| N | C32 | H322 | 109.4° | 106.7° |
| C32 | N | C1N | 112.5° | 110.8° |
| C32 | N | C2N | 109.7° | 110.8° |
| C32 | N | C3N | 109.2° | 110.7° |
| H321 | C32 | H322 | 109.5° | 110.4° |
| C1N | N | C2N | 107.9° | 108.2° |
| C1N | N | C3N | 109.2° | 108.1° |
| N | C1N | H1N1 | 109.5° | 107.8° |
| N | C1N | H1N2 | 109.4° | 107.9° |
| N | C1N | H1N3 | 109.5° | 107.8° |
| C2N | N | C3N | 108.2° | 108.2° |
| N | C2N | H2N1 | 109.5° | 107.8° |
| N | C2N | H2N2 | 109.5° | 107.8° |
| N | C2N | H2N3 | 109.4° | 107.8° |
| N | C3N | H3N1 | 109.5° | 107.8° |
| N | C3N | H3N2 | 109.5° | 107.9° |
| N | C3N | H3N3 | 109.4° | 107.7° |
| H1N1 | C1N | H1N2 | 109.5° | 111.1° |
| H1N1 | C1N | H1N3 | 109.4° | 111.1° |
| H1N2 | C1N | H1N3 | 109.5° | 111.0° |
| H2N1 | C2N | H2N2 | 109.5° | 111.0° |
| H2N1 | C2N | H2N3 | 109.4° | 111.1° |
| H2N2 | C2N | H2N3 | 109.5° | 111.1° |
| H3N1 | C3N | H3N2 | 109.5° | 111.1° |
| H3N1 | C3N | H3N3 | 109.4° | 111.1° |
| H3N2 | C3N | H3N3 | 109.5° | 111.1° |
| C14 | C13 | H131 | 109.0° | 107.9° |
| C14 | C13 | H132 | 108.7° | 109.6° |
| C13 | C14 | C15 | 108.7° | 113.5° |
| C13 | C14 | H141 | 109.7° | 109.6° |
| C13 | C14 | H142 | 109.9° | 108.1° |
| H131 | C13 | H132 | 110.5° | 106.6° |
| C15 | C14 | H141 | 109.7° | 109.8° |
| C15 | C14 | H142 | 109.9° | 109.0° |
| C14 | C15 | C16 | 109.3° | 111.2° |
| C14 | C15 | H151 | 109.5° | 110.1° |
| C14 | C15 | H152 | 109.6° | 109.6° |
| H141 | C14 | H142 | 108.9° | 106.7° |
| C16 | C15 | H151 | 109.5° | 109.0° |
| C16 | C15 | H152 | 109.5° | 109.6° |
| C15 | C16 | C17 | 24.4° | 111.3° |
| C15 | C16 | H161 | 156.6° | 109.0° |
| C15 | C16 | H162 | 157.8° | 109.7° |
| H151 | C15 | H152 | 109.3° | 107.3° |
| C17 | C16 | H161 | 156.6° | 110.0° |
| C17 | C16 | H162 | 157.8° | 109.6° |
| C16 | C17 | C18 | 90.0° | 113.5° |
| C16 | C17 | H171 | 90.0° | 109.9° |
| C16 | C17 | H172 | 90.0° | 109.0° |
| H161 | C16 | H162 | 38.8° | 107.3° |
| C18 | C17 | H171 | 90.0° | 110.0° |
| C18 | C17 | H172 | 90.0° | 107.9° |
| C17 | C18 | C19 | 90.0° | 115.8° |
| C17 | C18 | H181 | 90.0° | 108.3° |
| C17 | C18 | H182 | 90.0° | 108.8° |
| H171 | C17 | H172 | 90.0° | 106.1° |
| C19 | C18 | H181 | 90.0° | 108.8° |
| C19 | C18 | H182 | 90.0° | 108.3° |
| C18 | C19 | C20 | 90.0° | 113.5° |
| C18 | C19 | H191 | 90.0° | 108.0° |
| C18 | C19 | H192 | 90.0° | 110.0° |
| H181 | C18 | H182 | 90.0° | 106.3° |
| C20 | C19 | H191 | 90.0° | 109.0° |
| C20 | C19 | H192 | 90.0° | 109.8° |
| C19 | C20 | C21 | 90.0° | 111.2° |
| C19 | C20 | H201 | 90.0° | 110.1° |
| C19 | C20 | H202 | 90.0° | 109.6° |
| H191 | C19 | H192 | 90.0° | 106.2° |
| C21 | C20 | H201 | 90.0° | 108.9° |
| C21 | C20 | H202 | 90.0° | 109.7° |
| C20 | C21 | C22 | 90.0° | 111.2° |
| C20 | C21 | H211 | 90.0° | 108.8° |
| C20 | C21 | H212 | 90.0° | 109.6° |
| H201 | C20 | H202 | 90.0° | 107.3° |
| C22 | C21 | H211 | 90.0° | 110.2° |
| C22 | C21 | H212 | 90.0° | 109.5° |
| C21 | C22 | C23 | 90.0° | 113.5° |
| C21 | C22 | H221 | 90.0° | 109.9° |
| C21 | C22 | H222 | 90.0° | 109.0° |
| H211 | C21 | H212 | 90.0° | 107.3° |
| C23 | C22 | H221 | 90.0° | 110.0° |
| C23 | C22 | H222 | 90.0° | 108.0° |
| C22 | C23 | C24 | 90.0° | 115.8° |
| C22 | C23 | H231 | 90.0° | 108.3° |
| C22 | C23 | H232 | 90.0° | 108.9° |
| H221 | C22 | H222 | 90.0° | 106.1° |
| C24 | C23 | H231 | 90.0° | 108.8° |
| C24 | C23 | H232 | 90.0° | 108.4° |
| C23 | C24 | C25 | 90.0° | 113.4° |
| C23 | C24 | H241 | 90.0° | 107.9° |
| C23 | C24 | H242 | 90.0° | 109.6° |
| H231 | C23 | H232 | 90.0° | 106.2° |
| C25 | C24 | H241 | 90.0° | 109.0° |
| C25 | C24 | H242 | 90.0° | 110.4° |
| C24 | C25 | C26 | 90.0° | 113.3° |
| C24 | C25 | H251 | 90.0° | 110.3° |
| C24 | C25 | H252 | 90.0° | 109.0° |
| H241 | C24 | H242 | 90.0° | 106.3° |
| C26 | C25 | H251 | 90.0° | 109.5° |
| C26 | C25 | H252 | 90.0° | 108.0° |
| C25 | C26 | C27 | 90.0° | 115.6° |
| C25 | C26 | H261 | 90.0° | 108.3° |
| C25 | C26 | H262 | 90.0° | 108.9° |
| H251 | C25 | H252 | 90.0° | 106.4° |
| C27 | C26 | H261 | 90.0° | 108.8° |
| C27 | C26 | H262 | 90.0° | 108.5° |
| C26 | C27 | C28 | 90.0° | 113.6° |
| C26 | C27 | H271 | 90.0° | 108.2° |
| C26 | C27 | H272 | 90.0° | 110.4° |
| H261 | C26 | H262 | 90.0° | 106.3° |
| C28 | C27 | H271 | 90.0° | 108.5° |
| C28 | C27 | H272 | 90.0° | 109.5° |
| C27 | C28 | H281 | 90.0° | 110.1° |
| C27 | C28 | H282 | 90.0° | 111.5° |
| C27 | C28 | H283 | 90.0° | 111.0° |
| H271 | C27 | H272 | 90.0° | 106.3° |
| H281 | C28 | H282 | 90.0° | 107.6° |
| H281 | C28 | H283 | 90.0° | 108.0° |
| H282 | C28 | H283 | 90.0° | 108.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | H11 | 120.0° | 118.8° |
| O1 | C1 | C2 | H12 | 119.9° | 118.9° |
| O1 | C1 | H11 | H12 | 119.9° | 117.3° |
| O1 | C1 | C2 | O2H | 56.1° | 59.5° |
| O1 | C1 | C2 | C3 | 175.7° | 178.8° |
| O1 | C1 | C2 | H21 | 64.7° | 57.0° |
| C1 | O1 | C11 | C12 | 154.1° | 180.0° |
| C1 | O1 | C11 | H111 | 34.1° | 58.1° |
| C1 | O1 | C11 | H112 | 86.3° | 59.8° |
| C2 | C1 | H11 | H12 | 119.9° | 123.2° |
| C2 | C1 | O1 | C11 | 138.6° | 179.1° |
| C1 | C2 | O2H | C3 | 119.9° | 121.0° |
| C1 | C2 | O2H | H21 | 120.5° | 119.0° |
| C1 | C2 | C3 | H21 | 120.5° | 124.0° |
| C1 | C2 | O2H | HO21 | 27.4° | 7.5° |
| C1 | C2 | C3 | O3 | 162.4° | 179.8° |
| C1 | C2 | C3 | H31 | 77.6° | 60.0° |
| C1 | C2 | C3 | H32 | 43.7° | 61.6° |
| H11 | C1 | O1 | C11 | 101.3° | 60.0° |
| H11 | C1 | C2 | O2H | 63.9° | 59.3° |
| H11 | C1 | C2 | C3 | 55.7° | 60.0° |
| H11 | C1 | C2 | H21 | 175.3° | 175.8° |
| H12 | C1 | O1 | C11 | 18.7° | 58.2° |
| H12 | C1 | C2 | O2H | 176.1° | 178.4° |
| H12 | C1 | C2 | C3 | 64.4° | 62.3° |
| H12 | C1 | C2 | H21 | 55.3° | 61.9° |
| O1 | C11 | C12 | H111 | 120.0° | 120.6° |
| O1 | C11 | C12 | H112 | 119.5° | 119.1° |
| O1 | C11 | H111 | H112 | 119.5° | 117.7° |
| O1 | C11 | C12 | C13 | 17.2° | 179.4° |
| O1 | C11 | C12 | H121 | 137.2° | 59.7° |
| O1 | C11 | C12 | H122 | 102.0° | 57.6° |
| O2H | C2 | C3 | H21 | 120.8° | 117.2° |
| O2H | C2 | C3 | O3 | 78.9° | 61.3° |
| O2H | C2 | C3 | H31 | 41.1° | 178.9° |
| O2H | C2 | C3 | H32 | 162.3° | 57.2° |
| C3 | C2 | O2H | HO21 | 92.5° | 128.5° |
| C2 | C3 | O3 | H31 | 120.0° | 122.0° |
| C2 | C3 | O3 | H32 | 118.8° | 120.9° |
| C2 | C3 | H31 | H32 | 118.8° | 123.0° |
| C2 | C3 | O3 | P | 154.5° | 179.9° |
| H21 | C2 | O2H | HO21 | 147.9° | 111.5° |
| H21 | C2 | C3 | O3 | 41.9° | 55.9° |
| H21 | C2 | C3 | H31 | 161.9° | 63.9° |
| H21 | C2 | C3 | H32 | 76.8° | 174.4° |
| O3 | C3 | H31 | H32 | 118.9° | 116.1° |
| C3 | O3 | P | O31 | 20.1° | 59.9° |
| C3 | O3 | P | O32 | 109.7° | 174.9° |
| C3 | O3 | P | O33 | 131.9° | 66.3° |
| H31 | C3 | O3 | P | 34.5° | 58.0° |
| H32 | C3 | O3 | P | 86.8° | 59.1° |
| C12 | C11 | H111 | H112 | 119.6° | 121.1° |
| C11 | C12 | C13 | H121 | 120.0° | 121.1° |
| C11 | C12 | C13 | H122 | 119.2° | 120.9° |
| C11 | C12 | H121 | H122 | 119.2° | 117.7° |
| C11 | C12 | C13 | C14 | 98.9° | 179.0° |
| C11 | C12 | C13 | H131 | 21.1° | 60.6° |
| C11 | C12 | C13 | H132 | 141.6° | 56.1° |
| H111 | C11 | C12 | C13 | 102.8° | 60.0° |
| H111 | C11 | C12 | H121 | 17.2° | 60.8° |
| H111 | C11 | C12 | H122 | 138.0° | 178.1° |
| H112 | C11 | C12 | C13 | 136.8° | 60.3° |
| H112 | C11 | C12 | H121 | 103.3° | 178.9° |
| H112 | C11 | C12 | H122 | 17.6° | 61.5° |
| C13 | C12 | H121 | H122 | 119.2° | 119.5° |
| C12 | C13 | C14 | H131 | 120.0° | 121.2° |
| C12 | C13 | C14 | H132 | 119.4° | 123.0° |
| C12 | C13 | H131 | H132 | 119.5° | 118.6° |
| C12 | C13 | C14 | C15 | 133.9° | 178.7° |
| C12 | C13 | C14 | H141 | 13.9° | 55.7° |
| C12 | C13 | C14 | H142 | 105.8° | 60.3° |
| H121 | C12 | C13 | C14 | 141.1° | 59.9° |
| H121 | C12 | C13 | H131 | 98.9° | 60.5° |
| H121 | C12 | C13 | H132 | 21.6° | 177.1° |
| H122 | C12 | C13 | C14 | 20.2° | 58.1° |
| H122 | C12 | C13 | H131 | 140.3° | 178.6° |
| H122 | C12 | C13 | H132 | 99.2° | 64.8° |
| O3 | P | O31 | O32 | 124.9° | 119.3° |
| O3 | P | O31 | O33 | 108.6° | 119.8° |
| O3 | P | O32 | O33 | 112.7° | 107.6° |
| O3 | P | O32 | HO31 | 93.4° | 80.2° |
| O3 | P | O33 | C31 | 74.6° | 53.7° |
| O31 | P | O32 | O33 | 124.2° | 126.6° |
| O31 | P | O32 | HO31 | 143.6° | 45.7° |
| O31 | P | O33 | C31 | 37.0° | 180.0° |
| O32 | P | O33 | C31 | 167.6° | 54.0° |
| O33 | P | O32 | HO31 | 19.3° | 172.2° |
| P | O33 | C31 | C32 | 160.1° | 180.0° |
| P | O33 | C31 | H311 | 40.1° | 60.4° |
| P | O33 | C31 | H312 | 80.1° | 57.5° |
| O33 | C31 | C32 | H311 | 120.0° | 118.4° |
| O33 | C31 | C32 | H312 | 119.8° | 120.9° |
| O33 | C31 | H311 | H312 | 119.9° | 118.1° |
| O33 | C31 | C32 | N | 99.1° | 178.4° |
| O33 | C31 | C32 | H321 | 140.9° | 63.9° |
| O33 | C31 | C32 | H322 | 20.8° | 60.6° |
| C32 | C31 | H311 | H312 | 119.8° | 122.5° |
| C31 | C32 | N | H321 | 120.0° | 121.2° |
| C31 | C32 | N | H322 | 120.0° | 121.0° |
| C31 | C32 | H321 | H322 | 120.0° | 125.3° |
| C31 | C32 | N | C1N | 123.0° | 61.2° |
| C31 | C32 | N | C2N | 116.9° | 58.8° |
| C31 | C32 | N | C3N | 1.5° | 178.8° |
| H311 | C31 | C32 | N | 20.9° | 60.0° |
| H311 | C31 | C32 | H321 | 99.1° | 177.7° |
| H311 | C31 | C32 | H322 | 140.9° | 57.8° |
| H312 | C31 | C32 | N | 141.0° | 60.7° |
| H312 | C31 | C32 | H321 | 21.0° | 56.9° |
| H312 | C31 | C32 | H322 | 99.0° | 178.5° |
| N | C32 | H321 | H322 | 119.9° | 115.4° |
| C32 | N | C1N | C2N | 121.2° | 121.6° |
| C32 | N | C1N | C3N | 121.4° | 121.5° |
| C32 | N | C2N | C3N | 119.0° | 121.5° |
| C32 | N | C1N | H1N1 | 85.0° | 171.6° |
| C32 | N | C1N | H1N2 | 35.0° | 51.5° |
| C32 | N | C1N | H1N3 | 155.1° | 68.5° |
| C32 | N | C2N | H2N1 | 110.7° | 116.1° |
| C32 | N | C2N | H2N2 | 9.3° | 124.0° |
| C32 | N | C2N | H2N3 | 129.3° | 3.9° |
| C32 | N | C3N | H3N1 | 27.3° | 57.0° |
| C32 | N | C3N | H3N2 | 147.4° | 63.1° |
| C32 | N | C3N | H3N3 | 92.6° | 176.9° |
| H321 | C32 | N | C1N | 3.0° | 60.0° |
| H321 | C32 | N | C2N | 123.1° | 180.0° |
| H321 | C32 | N | C3N | 118.5° | 60.0° |
| H322 | C32 | N | C1N | 117.0° | 177.8° |
| H322 | C32 | N | C2N | 3.1° | 62.2° |
| H322 | C32 | N | C3N | 121.5° | 57.8° |
| C1N | N | C2N | C3N | 118.1° | 116.9° |
| N | C1N | H1N1 | H1N2 | 120.0° | 118.0° |
| N | C1N | H1N1 | H1N3 | 120.0° | 117.9° |
| N | C1N | H1N2 | H1N3 | 120.0° | 117.9° |
| C1N | N | C2N | H2N1 | 12.2° | 122.3° |
| C1N | N | C2N | H2N2 | 132.2° | 2.4° |
| C1N | N | C2N | H2N3 | 107.8° | 117.7° |
| C1N | N | C3N | H3N1 | 96.1° | 178.5° |
| C1N | N | C3N | H3N2 | 23.9° | 58.4° |
| C1N | N | C3N | H3N3 | 144.0° | 61.6° |
| C2N | N | C1N | H1N1 | 153.8° | 66.9° |
| C2N | N | C1N | H1N2 | 86.1° | 173.1° |
| C2N | N | C1N | H1N3 | 33.9° | 53.1° |
| N | C2N | H2N1 | H2N2 | 120.0° | 117.9° |
| N | C2N | H2N1 | H2N3 | 120.0° | 117.9° |
| N | C2N | H2N2 | H2N3 | 120.0° | 117.9° |
| C2N | N | C3N | H3N1 | 146.7° | 64.6° |
| C2N | N | C3N | H3N2 | 93.3° | 175.3° |
| C2N | N | C3N | H3N3 | 26.8° | 55.4° |
| C3N | N | C1N | H1N1 | 36.4° | 50.1° |
| C3N | N | C1N | H1N2 | 156.5° | 70.0° |
| C3N | N | C1N | H1N3 | 83.5° | 170.0° |
| C3N | N | C2N | H2N1 | 130.2° | 5.4° |
| C3N | N | C2N | H2N2 | 109.8° | 114.5° |
| C3N | N | C2N | H2N3 | 10.3° | 125.4° |
| N | C3N | H3N1 | H3N2 | 120.0° | 118.0° |
| N | C3N | H3N1 | H3N3 | 119.9° | 117.8° |
| N | C3N | H3N2 | H3N3 | 120.0° | 117.8° |
| H1N1 | C1N | H1N2 | H1N3 | 119.9° | 124.1° |
| H2N1 | C2N | H2N2 | H2N3 | 120.0° | 124.1° |
| H3N1 | C3N | H3N2 | H3N3 | 120.0° | 124.2° |
| C14 | C13 | H131 | H132 | 119.4° | 117.7° |
| C13 | C14 | C15 | H141 | 120.0° | 122.9° |
| C13 | C14 | C15 | H142 | 120.3° | 120.5° |
| C13 | C14 | H141 | H142 | 120.3° | 116.8° |
| C13 | C14 | C15 | C16 | 113.4° | 177.0° |
| C13 | C14 | C15 | H151 | 6.6° | 62.0° |
| C13 | C14 | C15 | H152 | 126.5° | 55.7° |
| H131 | C13 | C14 | C15 | 106.0° | 60.0° |
| H131 | C13 | C14 | H141 | 133.9° | 176.9° |
| H131 | C13 | C14 | H142 | 14.3° | 61.0° |
| H132 | C13 | C14 | C15 | 14.5° | 55.7° |
| H132 | C13 | C14 | H141 | 105.5° | 67.3° |
| H132 | C13 | C14 | H142 | 134.8° | 176.7° |
| C15 | C14 | H141 | H142 | 120.3° | 118.0° |
| C14 | C15 | C16 | H151 | 120.0° | 121.6° |
| C14 | C15 | C16 | H152 | 120.1° | 121.3° |
| C14 | C15 | H151 | H152 | 120.1° | 119.2° |
| C14 | C15 | C16 | C17 | 165.7° | 178.4° |
| C14 | C15 | C16 | H161 | 74.3° | 60.1° |
| C14 | C15 | C16 | H162 | 43.7° | 57.1° |
| H141 | C14 | C15 | C16 | 126.6° | 60.0° |
| H141 | C14 | C15 | H151 | 113.4° | 60.9° |
| H141 | C14 | C15 | H152 | 6.5° | 178.7° |
| H142 | C14 | C15 | C16 | 6.9° | 56.5° |
| H142 | C14 | C15 | H151 | 126.9° | 177.5° |
| H142 | C14 | C15 | H152 | 113.2° | 64.8° |
| C16 | C15 | H151 | H152 | 120.0° | 118.6° |
| C15 | C16 | C17 | H161 | 119.9° | 120.9° |
| C15 | C16 | C17 | H162 | 122.0° | 121.4° |
| C15 | C16 | H161 | H162 | 147.8° | 118.7° |
| C15 | C16 | C17 | C18 | 90.0° | 179.2° |
| C15 | C16 | C17 | H171 | 90.0° | 57.1° |
| C15 | C16 | C17 | H172 | 90.0° | 58.8° |
| H151 | C15 | C16 | C17 | 45.7° | 60.0° |
| H151 | C15 | C16 | H161 | 165.7° | 61.5° |
| H151 | C15 | C16 | H162 | 76.3° | 178.7° |
| H152 | C15 | C16 | C17 | 74.2° | 57.2° |
| H152 | C15 | C16 | H161 | 45.8° | 178.7° |
| H152 | C15 | C16 | H162 | 163.8° | 64.2° |
| C17 | C16 | H161 | H162 | 147.9° | 119.1° |
| C16 | C17 | C18 | H171 | 90.0° | 123.6° |
| C16 | C17 | C18 | H172 | 90.0° | 121.0° |
| C16 | C17 | H171 | H172 | 90.0° | 117.8° |
| C16 | C17 | C18 | C19 | 90.0° | 176.4° |
| C16 | C17 | C18 | H181 | 90.0° | 53.9° |
| C16 | C17 | C18 | H182 | 90.0° | 61.3° |
| H161 | C16 | C17 | C18 | 90.0° | 60.0° |
| H161 | C16 | C17 | H171 | 90.0° | 63.8° |
| H161 | C16 | C17 | H172 | 90.0° | 179.7° |
| H162 | C16 | C17 | C18 | 90.0° | 57.7° |
| H162 | C16 | C17 | H171 | 90.0° | 178.5° |
| H162 | C16 | C17 | H172 | 90.0° | 62.6° |
| C18 | C17 | H171 | H172 | 90.0° | 116.5° |
| C17 | C18 | C19 | H181 | 90.0° | 122.3° |
| C17 | C18 | C19 | H182 | 90.0° | 122.5° |
| C17 | C18 | H181 | H182 | 90.0° | 116.8° |
| C17 | C18 | C19 | C20 | 90.0° | 177.7° |
| C17 | C18 | C19 | H191 | 90.0° | 56.7° |
| C17 | C18 | C19 | H192 | 90.0° | 58.8° |
| H171 | C17 | C18 | C19 | 90.0° | 59.9° |
| H171 | C17 | C18 | H181 | 90.0° | 177.5° |
| H171 | C17 | C18 | H182 | 90.0° | 62.3° |
| H172 | C17 | C18 | C19 | 90.0° | 55.4° |
| H172 | C17 | C18 | H181 | 90.0° | 67.1° |
| H172 | C17 | C18 | H182 | 90.0° | 177.7° |
| C19 | C18 | H181 | H182 | 90.0° | 116.5° |
| C18 | C19 | C20 | H191 | 90.0° | 120.4° |
| C18 | C19 | C20 | H192 | 90.0° | 123.6° |
| C18 | C19 | H191 | H192 | 90.0° | 118.0° |
| C18 | C19 | C20 | C21 | 90.0° | 179.6° |
| C18 | C19 | C20 | H201 | 90.0° | 58.8° |
| C18 | C19 | C20 | H202 | 90.0° | 59.0° |
| H181 | C18 | C19 | C20 | 90.0° | 60.0° |
| H181 | C18 | C19 | H191 | 90.0° | 179.0° |
| H181 | C18 | C19 | H192 | 90.0° | 63.5° |
| H182 | C18 | C19 | C20 | 90.0° | 55.2° |
| H182 | C18 | C19 | H191 | 90.0° | 65.8° |
| H182 | C18 | C19 | H192 | 90.0° | 178.7° |
| C20 | C19 | H191 | H192 | 90.0° | 118.2° |
| C19 | C20 | C21 | H201 | 90.0° | 121.5° |
| C19 | C20 | C21 | H202 | 90.0° | 121.3° |
| C19 | C20 | H201 | H202 | 90.0° | 119.2° |
| C19 | C20 | C21 | C22 | 90.0° | 178.5° |
| C19 | C20 | C21 | H211 | 90.0° | 59.9° |
| C19 | C20 | C21 | H212 | 90.0° | 57.2° |
| H191 | C19 | C20 | C21 | 90.0° | 59.9° |
| H191 | C19 | C20 | H201 | 90.0° | 179.2° |
| H191 | C19 | C20 | H202 | 90.0° | 61.4° |
| H192 | C19 | C20 | C21 | 90.0° | 56.0° |
| H192 | C19 | C20 | H201 | 90.0° | 64.8° |
| H192 | C19 | C20 | H202 | 90.0° | 177.4° |
| C21 | C20 | H201 | H202 | 90.0° | 118.6° |
| C20 | C21 | C22 | H211 | 90.0° | 120.8° |
| C20 | C21 | C22 | H212 | 90.0° | 121.4° |
| C20 | C21 | H211 | H212 | 90.0° | 118.6° |
| C20 | C21 | C22 | C23 | 90.0° | 179.3° |
| C20 | C21 | C22 | H221 | 90.0° | 57.1° |
| C20 | C21 | C22 | H222 | 90.0° | 58.8° |
| H201 | C20 | C21 | C22 | 90.0° | 60.0° |
| H201 | C20 | C21 | H211 | 90.0° | 61.6° |
| H201 | C20 | C21 | H212 | 90.0° | 178.7° |
| H202 | C20 | C21 | C22 | 90.0° | 57.2° |
| H202 | C20 | C21 | H211 | 90.0° | 178.7° |
| H202 | C20 | C21 | H212 | 90.0° | 64.2° |
| C22 | C21 | H211 | H212 | 90.0° | 119.2° |
| C21 | C22 | C23 | H221 | 90.0° | 123.5° |
| C21 | C22 | C23 | H222 | 90.0° | 121.0° |
| C21 | C22 | H221 | H222 | 90.0° | 117.7° |
| C21 | C22 | C23 | C24 | 90.0° | 176.4° |
| C21 | C22 | C23 | H231 | 90.0° | 54.0° |
| C21 | C22 | C23 | H232 | 90.0° | 61.1° |
| H211 | C21 | C22 | C23 | 90.0° | 60.0° |
| H211 | C21 | C22 | H221 | 90.0° | 63.7° |
| H211 | C21 | C22 | H222 | 90.0° | 179.6° |
| H212 | C21 | C22 | C23 | 90.0° | 57.9° |
| H212 | C21 | C22 | H221 | 90.0° | 178.5° |
| H212 | C21 | C22 | H222 | 90.0° | 62.6° |
| C23 | C22 | H221 | H222 | 90.0° | 116.7° |
| C22 | C23 | C24 | H231 | 90.0° | 122.2° |
| C22 | C23 | C24 | H232 | 90.0° | 122.7° |
| C22 | C23 | H231 | H232 | 90.0° | 116.8° |
| C22 | C23 | C24 | C25 | 90.0° | 177.8° |
| C22 | C23 | C24 | H241 | 90.0° | 56.9° |
| C22 | C23 | C24 | H242 | 90.0° | 58.5° |
| H221 | C22 | C23 | C24 | 90.0° | 60.0° |
| H221 | C22 | C23 | H231 | 90.0° | 177.5° |
| H221 | C22 | C23 | H232 | 90.0° | 62.4° |
| H222 | C22 | C23 | C24 | 90.0° | 55.4° |
| H222 | C22 | C23 | H231 | 90.0° | 67.0° |
| H222 | C22 | C23 | H232 | 90.0° | 177.8° |
| C24 | C23 | H231 | H232 | 90.0° | 116.5° |
| C23 | C24 | C25 | H241 | 90.0° | 120.3° |
| C23 | C24 | C25 | H242 | 90.0° | 123.3° |
| C23 | C24 | H241 | H242 | 90.0° | 117.5° |
| C23 | C24 | C25 | C26 | 90.0° | 179.7° |
| C23 | C24 | C25 | H251 | 90.0° | 56.6° |
| C23 | C24 | C25 | H252 | 90.0° | 60.0° |
| H231 | C23 | C24 | C25 | 90.0° | 60.0° |
| H231 | C23 | C24 | H241 | 90.0° | 179.1° |
| H231 | C23 | C24 | H242 | 90.0° | 63.7° |
| H232 | C23 | C24 | C25 | 90.0° | 55.1° |
| H232 | C23 | C24 | H241 | 90.0° | 65.8° |
| H232 | C23 | C24 | H242 | 90.0° | 178.8° |
| C25 | C24 | H241 | H242 | 90.0° | 119.0° |
| C24 | C25 | C26 | H251 | 90.0° | 123.6° |
| C24 | C25 | C26 | H252 | 90.0° | 120.9° |
| C24 | C25 | H251 | H252 | 90.0° | 118.1° |
| C24 | C25 | C26 | C27 | 90.0° | 176.3° |
| C24 | C25 | C26 | H261 | 90.0° | 54.0° |
| C24 | C25 | C26 | H262 | 90.0° | 61.2° |
| H241 | C24 | C25 | C26 | 90.0° | 60.0° |
| H241 | C24 | C25 | H251 | 90.0° | 176.8° |
| H241 | C24 | C25 | H252 | 90.0° | 60.3° |
| H242 | C24 | C25 | C26 | 90.0° | 56.4° |
| H242 | C24 | C25 | H251 | 90.0° | 66.8° |
| H242 | C24 | C25 | H252 | 90.0° | 176.7° |
| C26 | C25 | H251 | H252 | 90.0° | 116.5° |
| C25 | C26 | C27 | H261 | 90.0° | 122.1° |
| C25 | C26 | C27 | H262 | 90.0° | 122.7° |
| C25 | C26 | H261 | H262 | 90.0° | 116.9° |
| C25 | C26 | C27 | C28 | 90.0° | 177.9° |
| C25 | C26 | C27 | H271 | 90.0° | 57.3° |
| C25 | C26 | C27 | H272 | 90.0° | 58.6° |
| H251 | C25 | C26 | C27 | 90.0° | 60.1° |
| H251 | C25 | C26 | H261 | 90.0° | 177.6° |
| H251 | C25 | C26 | H262 | 90.0° | 62.4° |
| H252 | C25 | C26 | C27 | 90.0° | 55.5° |
| H252 | C25 | C26 | H261 | 90.0° | 66.9° |
| H252 | C25 | C26 | H262 | 90.0° | 177.9° |
| C27 | C26 | H261 | H262 | 90.0° | 116.6° |
| C26 | C27 | C28 | H271 | 90.0° | 120.4° |
| C26 | C27 | C28 | H272 | 90.0° | 124.0° |
| C26 | C27 | H271 | H272 | 90.0° | 118.6° |
| C26 | C27 | C28 | H281 | 90.0° | 173.9° |
| C26 | C27 | C28 | H282 | 90.0° | 66.7° |
| C26 | C27 | C28 | H283 | 90.0° | 54.3° |
| H261 | C26 | C27 | C28 | 90.0° | 60.0° |
| H261 | C26 | C27 | H271 | 90.0° | 179.5° |
| H261 | C26 | C27 | H272 | 90.0° | 63.5° |
| H262 | C26 | C27 | C28 | 90.0° | 55.2° |
| H262 | C26 | C27 | H271 | 90.0° | 65.3° |
| H262 | C26 | C27 | H272 | 90.0° | 178.7° |
| C28 | C27 | H271 | H272 | 90.0° | 117.7° |
| C27 | C28 | H281 | H282 | 90.0° | 121.7° |
| C27 | C28 | H281 | H283 | 90.0° | 121.4° |
| C27 | C28 | H282 | H283 | 90.0° | 122.5° |
| H271 | C27 | C28 | H281 | 90.0° | 53.5° |
| H271 | C27 | C28 | H282 | 90.0° | 172.9° |
| H271 | C27 | C28 | H283 | 90.0° | 66.1° |
| H272 | C27 | C28 | H281 | 90.0° | 62.1° |
| H272 | C27 | C28 | H282 | 90.0° | 57.3° |
| H272 | C27 | C28 | H283 | 90.0° | 178.3° |
| H281 | C28 | H282 | H283 | 90.0° | 116.6° |
